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Profile: Advance Scientific & Chemical, Inc. is a distributor of laboratory chemicals and supplies. We specialize in ACS, USP, FCC, NF and technical grade chemicals. We supply glassware, laboratory equipment, and laboratory supplies. Our product line includes acetic acid, acetonitrile, acetovanillone, acrolein diethyl acetal, barium bromide, dihydrate, barium chloride, bathophenanthroline, adhesives, cadmium molybdate, cadmium selenite, and denatonium saccharide.

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• 1-Heptyne
IUPAC Name: hept-1-yne | CAS Registry Number: 628-71-7
Synonyms: Amylacetylene, 1-HEPTYNE, hept-1-yne, Ambap3104, 244414_ALDRICH, 51950_FLUKA, NSC9710, NSC 9710, EINECS 211-051-5, TL8004296, InChI=1/C7H12/c1-3-5-7-6-4-2/h1H,4-7H2,2H

Molecular Formula: C7H12Molecular Weight: 96.170180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YVXHZKKCZYLQOP-UHFFFAOYSA-N

• 1-Bromo-6-Chlorohexane
IUPAC Name: 1-bromo-6-chlorohexane | CAS Registry Number: 6294-17-3
Synonyms: 1-Bromo-6-chlorohexane, 6-Chlorohexyl bromide, 1-Chloro-6-bromohexane, Hexane, 1-bromo-6-chloro-, Hexyl bromide, 6-chloro-, NSC9249, 241652_ALDRICH, CID80516, NSC 9249, EINECS 228-555-6

Molecular Formula: C6H12BrClMolecular Weight: 199.516480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JTYUIAOHIYZBPB-UHFFFAOYSA-N

• 1,2,4-Trimethylbenzene
IUPAC Name: 1,2,4-trimethylbenzene | CAS Registry Number: 95-63-6
Synonyms: Pseudocumene, Pseudocumol, Psi-cumene, as-Trimethylbenzene, Uns-trimethylbenzene, .psi.-Cumene, 1,2,4-TRIMETHYLBENZENE, 1,3,4-Trimethylbenzene, Benzene, 1,2,4-trimethyl-, 1,2,5-Trimethylbenzene, Asymmetrical trimethylbenzene, 1,2,4-Trimethyl benzene, Benzene, 1,2,5-trimethyl-, T73601_ALDRICH, HSDB 5293, 47324_SUPELCO, Benzene, 1,2,3-trimethyl-, WLN: 1R B1 D1, 82540_FLUKA, CHEBI:34039

Molecular Formula: C9H12Molecular Weight: 120.191580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GWHJZXXIDMPWGX-UHFFFAOYSA-N

• 1,2-Dimyristoyl-Sn-Glycero-3-Phosphoethanolamine
IUPAC Name: [(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-tetradecanoyloxypropyl] tetradecanoate | CAS Registry Number: 998-07-2
Synonyms: 1,2-Dimyristoyl-sn-glycero-3-phosphoethanolamine, PE(14:0/14:0), 1,2-ditetradecanoyl-sn-glycero-3-phosphoethanolamine, 3-sn-Phosphatidylethanolamine, 1,2-dimyristoyl, P5693_SIGMA, GPEtn(28:0), Phophatidylethanolamine(28:0), CTK8F2901, HMDB08821, Dimyristoyl phosphatidylethanolamine, L-|A,|A-Dimyristoyl-|A-cephalin, GPEtn(14:0/14:0), LMGP02010352, Phophatidylethanolamine(14:0/14:0), AG-I-02546, L-beta,gamma-Dimyristoyl-alpha-cephalin, Dimyristoyl-L-|A-phosphatidylethanolamine, Dimyristoyl-L-alpha-phosphatidylethanolamine, 1,2-dimyristoyl-rac-glycero-3-phosphoethanolamine, Tetradecanoic acid (1R)-1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester

Molecular Formula: C33H66NO8PMolecular Weight: 635.852802 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: NEZDNQCXEZDCBI-WJOKGBTCSA-N

• 1-Naphthalenesulfonic Acid, Sodium Salt
IUPAC Name: naphthalene-1-sulfonic acid; sodium | CAS Registry Number: 130-14-3
Synonyms: alpha salt, Sodium 1-naphthalenesulfonate, Sodium .alpha.-naphthylsulfonate, Sodium .alpha.-naphthalenesulfonate, NSC37036, Sodium .alpha.-naphthalenesulfonic acid, 1-Naphthalenesulfonic acid, sodium salt, .alpha.-Naphthalenesulfonic acid sodium salt

Molecular Formula: C10H8NaO3SMolecular Weight: 231.223490 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CRVVHBFLWWQMPT-UHFFFAOYSA-N

• (+/-)-Trans-Azetidine-2,4-Dicarboxylic Acid
IUPAC Name: (2S,4S)-azetidin-1-ium-2,4-dicarboxylate | CAS Registry Number: 161596-62-9
Synonyms: ZINC02560277, ZINC02567715, CID7020765

Molecular Formula: C5H6NO4-Molecular Weight: 144.105440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JMVIGOFRIJJUAW-HRFVKAFMSA-M

• (+/-)-Benzyloxycarbonyl-alpha-phosphonoglycine trimethyl ester
IUPAC Name: methyl 2-dimethoxyphosphoryl-2-(phenylmethoxycarbonylamino)acetate | CAS Registry Number: 88568-95-0
Synonyms: 376353_ALDRICH, ()-Trimethyl Z-alpha-phosphonoglycinate, Z-alpha-Phosphonoglycine trimethyl ester, ()-Z-alpha-Phosphonoglycine trimethyl ester, N-Benzyloxycarbonyl trimethylphosphonoglycine, UX00003621, ()-Methyl 2-benzyloxycarbonylamino-2-(dimethoxyphosphinyl) acetate

Molecular Formula: C13H18NO7PMolecular Weight: 331.258281 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: GSYSFVSGPABNNL-UHFFFAOYSA-N

• (S)-(+)-Alpha-Methoxy-Alpha-Trifluoromethylphenylacetyl Chloride
IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride | CAS Registry Number: 39637-99-5
Synonyms: Mosher's acid chloride, (R)-(-)-MTPA-Cl, 65363_FLUKA, ZINC02584598, CID3080792, (-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, (R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, Benzeneacetyl chloride, alpha-methoxy-alpha-(trifluoromethyl)-, (R)-, 20445-33-4

Molecular Formula: C10H8ClF3O2Molecular Weight: 252.617530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: PAORVUMOXXAMPL-VIFPVBQESA-N

• 1-Chloronaphthalene
IUPAC Name: 1-chloronaphthalene | CAS Registry Number: 90-13-1
Synonyms: 1-CHLORONAPHTHALENE, xilamon, xylamon, Naphthalene, 1-chloro-, alpha-Chloronaphthalene, 1-Naphthyl chloride, alpha-Chlornaphthalene, .alpha.-Chloronaphthalene, alpha-Naphthyl chloride, 1-Chlornaftalen [Czech], .alpha.-Chlornaphthalene, CCRIS 5546, WLN: L66J BG, HSDB 5269, 442259U_SUPELCO, 185752_ALDRICH, NSC 6166, 25320_FLUKA, EINECS 201-967-3, NSC6166

Molecular Formula: C10H7ClMolecular Weight: 162.615580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JTPNRXUCIXHOKM-UHFFFAOYSA-N

• (S)-(+)-2-Phenylbutyric Acid
IUPAC Name: (2S)-2-phenylbutanoic acid | CAS Registry Number: 4286-15-1
Synonyms: (S)-(+)-2-Phenylbutyric acid, (2s)-2-phenylbutanoic acid, (S)-2-Phenylbutanoic acid, PubChem9874, AC1LFXAE, AC1Q5QZQ, SureCN67237, AC1Q2C6Z, 279889_ALDRICH, AC1Q2C70, CTK4I6709, (S)-()-2-phenyl-Mutyric Acid, KST-1A8854, (S)-(+)-2-phenyl-Mutyric Acid, AR-1A3279, Benzeneacetic acid, a-ethyl-, (aS)-, AG-A-07800, KB-211229

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OFJWFSNDPCAWDK-VIFPVBQESA-N

• 1,3-bis-(trimethylsilylethynyl)benzene
IUPAC Name: trimethyl-[2-[3-(2-trimethylsilylethynyl)phenyl]ethynyl]silane | CAS Registry Number: 38170-80-8
Synonyms: 1,3-Bis[(trimethylsilyl)ethynyl]benzene, CID142239, SBB008996, 1,3-Bis((trimethylsilyl)ethynyl)benzene

Molecular Formula: C16H22Si2Molecular Weight: 270.516880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ASZOZZMGMNVKDV-UHFFFAOYSA-N

• 1,2,10-Decanetriol
IUPAC Name: decane-1,2,10-triol | CAS Registry Number: 91717-85-0
Synonyms: Decane-1,2,10-triol, 1,2,10-Trihydroxydecane, ACMC-209rd3, AC1MC4E7, CTK3I6061, OR2126T, ANW-39733, D2721, FT-0606163

Molecular Formula: C10H22O3Molecular Weight: 190.279880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: RHINSRUDDXGHLV-UHFFFAOYSA-N

• (S)-(-)-2-Methyl-1-butanol
IUPAC Name: (2S)-2-methylbutan-1-ol | CAS Registry Number: 1565-80-6
Synonyms: Active amyl alcohol, Prim. active amyl alcohol, (S)-2-Methyl-1-butanol, (S)-2-Methylbutan-1-ol, (2S)-2-methyl-1-butanol, (2S)-2-methylbutan-1-ol, A83407_ALDRICH, D-2-METHYL-1-BUTANOL, 65979_FLUKA, 65980_FLUKA, CHEBI:50625, ZINC02040993, (S)-(−)-2-Methylbutanol, DL-2-METHYL-1-BUTANOL, PRACT, (S)-(−)-2-Methyl-1-butanol, 137-32-6

Molecular Formula: C5H12OMolecular Weight: 88.148180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QPRQEDXDYOZYLA-YFKPBYRVSA-N

• 1,3,5-Triacetylbenzene
IUPAC Name: 1-(3,5-diacetylphenyl)ethanone | CAS Registry Number: 779-90-8
Synonyms: 1,3,5,Triacetylbenzene, Benzene, 1,3,5-triacetyl-, NSC61943, STOCK2S-36931, 1-(3,5-diacetylphenyl)ethanone, CID69904, EINECS 212-302-1, STK262293, ZINC00332343, 1,1',1''-benzene-1,3,5-triyltriethanone, Ethanone, 1,1',1''-(1,3,5-benzenetriyl)tris-, AE-641/00125043, S01-0335

Molecular Formula: C12H12O3Molecular Weight: 204.221880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HSOAIPRTHLEQFI-UHFFFAOYSA-N

• 1-Benzyl-1H-indole-3-carbaldehyde
IUPAC Name: 1-(phenylmethyl)indole-3-carbaldehyde | CAS Registry Number: 10511-51-0
Synonyms: B8750_SIGMA, 1-Benzylindole-3-carboxaldehyde, NSC95434, 1-benzyl-1H-indole-3-carbaldehyde, ALBB-001166, ZERO/008656, CID262104, ZINC00087953

Molecular Formula: C16H13NOMolecular Weight: 235.280520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: OXCITQLDOUGVRZ-UHFFFAOYSA-N

• 1,5-Bis(4-Allyldimethyl-Ammoniumphenyl)Pentan-3-One Dibromide
IUPAC Name: [4-[5-[4-[dimethyl(prop-2-enyl)azaniumyl]phenyl]-3-oxopentyl]phenyl]-dimethyl-prop-2-enylazanium dibromide | CAS Registry Number: 402-40-4
Synonyms: BW284c51, CID9820, BW 284 C 51, BW-284-C-51, D002093, 1,5-Bis(4-allyldimethylammoniumphenyl)pentan-3-one dibromide, 4,4'-(3-Oxo-1,5-pentanediyl)bis(N,N-dimethyl-N-2-propenylbenzenaminium) dibromide, Benzenaminium, 4,4'-(3-oxo-1,5-pentanediyl)bis(N,N-dimethyl-N-2-propenyl)-, dibromide, Benzenaminium, 4,4'-(3-oxo-1,5-pentanediyl)bis(N,N-dimethyl-N-2-propenyl-), Dibromide, Benzenaminium, 4,4'-(3-oxo-1,5-pentanediyl)bis(N,N-dimethyl-N-2-propenyl-, dibromide

Molecular Formula: C27H38Br2N2OMolecular Weight: 566.411420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WKDURMTZOWGWTD-UHFFFAOYSA-L

• 2,3-Pyrazine Dicarboxylic Acid
IUPAC Name: pyrazine-2,3-dicarboxylic acid | CAS Registry Number: 89-01-0
Synonyms: 2,3-Pyrazinedicarboxylic acid, 2,3-Dicarboxypyrazine, Pyrazine-2,3-dicarboxylate, Pyrazine-2,3-dicarboxylic acid, Maybridge1_001780, P56208_ALDRICH, NSC1908, NSC 1908, EINECS 201-875-3, AIDS012682, AIDS-012682, BRN 0147982, NCI60_001592, LS-127602, ST5160363, TL8005761, P-8100, 5-25-05-00383 (Beilstein Handbook Reference), SR-01000635503-1

Molecular Formula: C6H4N2O4Molecular Weight: 168.106960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: ZUCRGHABDDWQPY-UHFFFAOYSA-N

• 15-Hydroxypentadecanoic Acid
IUPAC Name: 15-hydroxypentadecanoate | CAS Registry Number: 4617-33-8
Synonyms: 15-hydroxypentadecanoate, ZINC04284502, CPD-11594, CID7168225

Molecular Formula: C15H29O3-Molecular Weight: 257.388960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BZUNJUAMQZRJIP-UHFFFAOYSA-M

• 1,3-Dibromopropane
IUPAC Name: 1,3-dibromopropane | CAS Registry Number: 109-64-8
Synonyms: 1,3-DIBROMOPROPANE, Trimethylene dibromide, Trimethylene bromide, Propane, 1,3-dibromo-, alpha,gamma-Dibromopropane, .alpha.,.gamma.-Dibromopropane, WLN: E3E, CCRIS 6711, EINECS 203-690-3, HSDB 7408, .omega.,.omega.'-Dibromopropane, NSC 62663, 125903_SIAL, NSC62663, AI3-28592, LS-119947, TL8000305, InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H, 625084-38-0

Molecular Formula: C3H6Br2Molecular Weight: 201.887740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VEFLKXRACNJHOV-UHFFFAOYSA-N

• 1-Bromodocosane
IUPAC Name: 1-bromodocosane | CAS Registry Number: 6938-66-5
Synonyms: Behenyl bromide, Docosyl bromide, n-Docosyl bromide, Docosane, 1-bromo-, 332941_ALDRICH, 16960_FLUKA, LTBB002070, CID81355, NSC53991, EINECS 230-069-4

Molecular Formula: C22H45BrMolecular Weight: 389.496700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QYOXLKAKUAASNA-UHFFFAOYSA-N

• 1,2,4,5-Tetrachlorobenzene
IUPAC Name: 1,2,4,5-tetrachlorobenzene | CAS Registry Number: 95-94-3
Synonyms: s-Tetrachlorobenzene, Benzene tetrachloride, Tetrachlorobenzene, 1,2,4,5-TETRACHLOROBENZENE, Benzene, tetrachloro-, Benzene, 1,2,4,5-tetrachloro-, RCRA waste no. U207, RCRA waste number U207, TETRACHLOROBENZENES, Maybridge1_002304, CCRIS 766, WLN: GR BG DG EG, 1,2,4,5-Tetrachlorbenzol, HSDB 2733, MLS001055490, DivK1c_001056, CID7270, 131857_ALDRICH, 34379_RIEDEL, 442219_SUPELCO

Molecular Formula: C6H2Cl4Molecular Weight: 215.892080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JHBKHLUZVFWLAG-UHFFFAOYSA-N

• 1-Heptadecanol
IUPAC Name: heptadecan-1-ol | CAS Registry Number: 1454-85-9
Synonyms: n-Heptadecanol, Heptadecanol, Heptadecan-1-ol, HEPTADECYL ALCOHOL, Alcohols, C16-18, Prim-n-heptadecyl alcohol, 241695_ALDRICH, NSC 3921, EINECS 215-932-5, NSC3921, CHEBI:133253, HEPTADECANOL (mixed primary isomers), CID15076, AI3-01234, LS-74184, LS-74185, 52783-44-5, 67762-27-0

Molecular Formula: C17H36OMolecular Weight: 256.467140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GOQYKNQRPGWPLP-UHFFFAOYSA-N

• 1,4-Androstadiene-3,17-dione
IUPAC Name: (8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 897-06-3
Synonyms: Boldione, Androstadienedione, Mixture Name, 1-Dehydroandrostenedione, androsta-1,4-diene-3,17-dione, A7505_SIGMA, EINECS 212-977-2, 1h62, NSC 49080, BB_NC-0243, c1016, ZINC03881421, 1,4-ANDROSTADIEN-3,17-DIENE, LS-19326, ANB, 10,13-Dimethyl-7,8,9,10,11,12,13,14,15,16-decahydro-6H-cyclopenta[a]phenanthrene-3,17-dione, ADD, ASD

Molecular Formula: C19H24O2Molecular Weight: 284.392660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LUJVUUWNAPIQQI-QAGGRKNESA-N

• 1-Naphthyl Phosphate Monosodium Salt Monohydrate
IUPAC Name: naphthalen-1-yl phosphate | CAS Registry Number: 81012-89-7
Synonyms: ZINC01841117, CID5018845

Molecular Formula: C10H7O4P-2Molecular Weight: 222.133941 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YNXICDMQCQPQEW-UHFFFAOYSA-L

• 1-Ethyl-(3 Dimethylamino)Propyl Carbodiamide
IUPAC Name: 3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine hydrochloride | CAS Registry Number: 25952-53-8
Synonyms: EDCI, EDAC, Hydrochloride, EDAP, WLN: 2NCN3N1&1 &GH, NSC97064, [3-(Dimethylamino)propyl]ethyl carbodiimide hydrochloride, 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride, 1-Ethyl-3-(3′-dimethylaminopropyl)carbodiimide, HCl, 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride, N-ETHYL-N'(3-DIMETHYLAMINOPROPYL) CARBODIIMIDE HCl, 1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide hydrochloride, 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide monohydrochloride, 1-Ethyl-3-[(3-(dimethylamino)propyl]carbodiimide hydrochloride, 1-Ethyl-3-[3'-(dimethylamino)propyl]carbodiimide hydrochloride, Carbodiimide, [3-(dimethylamino)propyl]ethyl-, hydrochloride, N-[3-(Dimethylamino)propyl]-N'-ethylcarbodiimide hydrochloride, N-Ethyl-N'-(3-dimethylaminopropyl)carbodiimide hydrochloride, N-Ethyl-N'-[3-(dimethylamino)propyl]carbodiimide hydrochloride, 1-Ethyl-3-[3-(dimethylamino)propyl]carbodiimide monohydrochloride, CARBODIIMIDE, (3-DIMETHYLAMINOPROPYL)ETHYL-, HYDROCHLORIDE

Molecular Formula: C8H18ClN3Molecular Weight: 191.701620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FPQQSJJWHUJYPU-UHFFFAOYSA-N

• (+)-1-(9-Fluorenyl)ethyl Chloroformate Solution
IUPAC Name: [(1R)-1-(9H-fluoren-9-yl)ethyl] carbonochloridate | CAS Registry Number: 107474-79-3
Synonyms: FLEC, ZINC00389585, CID6950347

Molecular Formula: C16H13ClO2Molecular Weight: 272.726220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SFRVOKMRHPQYGE-SNVBAGLBSA-N

• 1-benzyl-3-piperidinol Base
IUPAC Name: 1-(phenylmethyl)piperidin-3-ol | CAS Registry Number: 14813-01-5
Synonyms: 1-benzyl-3-piperidinol, 1-Benzylpiperidin-3-ol, ChemDiv3_003156, N-Benzyl-3-hydroxypiperidine, Oprea1_553733, 1-Benzyl-3-hydroxypiperidine, MLS000532403, 653446_ALDRICH, EINECS 238-881-0, NSC111182, SDCCGMLS-0065815.P001, SMR000137361, ST5406114, TL8003358

Molecular Formula: C12H17NOMolecular Weight: 191.269480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UTTCOAGPVHRUFO-UHFFFAOYSA-N

• 2,3-Quinoxalinedione, 1,4-dihydro-
IUPAC Name: 1,4-dihydroquinoxaline-2,3-dione | CAS Registry Number: 15804-19-0
Synonyms: Quinoxaline-2,3-diol, 2,3-QUINOXALINEDIOL, 2,3-Dihydroxyquinoxaline, 1,4-Dihydro-2,3-quinoxalinedione, Quinoxaline, 2,3-dihydroxy-, USAF EK-6232, 2,3(1H,4H)-Quinoxalinedione, MLS000681641, 144789_ALDRICH, ARONIS014393, 2,3-DIHYDROXYGUINOXALINE, NSC 8698, EINECS 239-901-0, NSC8698, NSC9431, WLN: T66 BN ENJ CQ DQ, AIDS019740, AIDS-019740, SBB000138, ZINC00055215

Molecular Formula: C8H6N2O2Molecular Weight: 162.145440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ABJFBJGGLJVMAQ-UHFFFAOYSA-N

• 2,2,2-trichloroethanol
IUPAC Name: 2,2,2-trichloroethanol | CAS Registry Number: 115-20-8
Synonyms: Trichloroethanol, Trichlorethanol, Trichloroethyl alcohol, 2,2,2-TRICHLOROETHANOL, 4yas, Ethanol, 2,2,2-trichloro-, 2,2,2-Trichloro-1-ethanol, .beta.-Trichloroethanol, (Hydroxymethyl)trichloromethane, 2,2,2-Trichloroethyl alcohol, WLN: Q1XGGG, C2H3Cl3O, CCRIS 6763, T54801_ALDRICH, CHEBI:28094, EINECS 204-071-0, NSC 66407, .beta.,.beta.,.beta-Trichloroethanol, ETHANOL,2,2,2-TRICHLORO, CPD-9673

Molecular Formula: C2H3Cl3OMolecular Weight: 149.403620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KPWDGTGXUYRARH-UHFFFAOYSA-N

• 3-Chloro-1 2-Propanediol
IUPAC Name: 3-chloropropane-1,2-diol | CAS Registry Number: 96-24-2
Synonyms: alpha-Chlorohydrin, Epibloc, Monochlorohydrin, Chlorodeoxyglycerol, Monochlorhydrin, Chlorhydrin, Chloropropanediol, Chlorohydrin, Glyceryl chloride, 3-Chloro-1,2-propanediol, Glycerol chlorohydrin, alpha-Chlorohydrine, 3-Chloropropanediol, .alpha.-Chlorohydrin, 3-Chloropropane-1,2-diol, 3-Chloropropylene glycol, Caswell No. 214A, Glycerin epichlorohydrin, Glycerol 3-chlorohydrin, 1,2-Propanediol, 3-chloro-

Molecular Formula: C3H7ClO2Molecular Weight: 110.539480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSZWWUDQMAHNAQ-UHFFFAOYSA-N

• 1,4-Bromochlorobenzene
IUPAC Name: 1-bromo-4-chlorobenzene | CAS Registry Number: 106-39-8
Synonyms: p-Bromochlorobenzene, p-Chlorobromobenzene, 4-Chlorobromobenzene, 1-Bromo-4-chlorobenzene, Bromochlorobenzene, p-Chlorophenyl bromide, 4-Chlorophenyl bromide, 4-BROMOCHLOROBENZENE, Benzene, 1-bromo-4-chloro-, p-Bromophenyl chloride, 1-Chloro-4-bromobenzene, 4-Chloro-1-bromobenzene, B60428_ALDRICH, 442403_SUPELCO, 16660_FLUKA, EINECS 203-392-3, NSC 17587, NSC17587, AI3-15313, LS-29193

Molecular Formula: C6H4BrClMolecular Weight: 191.452960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NHDODQWIKUYWMW-UHFFFAOYSA-N

• 1,8-Naphthalic Anhydride
Synonyms: Protect, Pakarli, 1,8-Naphthalic anhydride, Naphthalic anhydride, Naphthalic acid anhydride, Protect (agrochemical), 1,8-Naphthalic acid anhydride, N1607_ALDRICH, Naphthalic anhydride (7CI,8CI), NSC 5747, 70320_FLUKA, EINECS 201-380-2, HSDB 7371, 1H,3H-Naphtho[1,8-cd]pyran-1,3-dione, NSC5747, WLN: T666 1A M CVOVJ, Naphthalene-1,8-dicarboxylic anhydride, 1,8-Naphthalenedicarboxylic acid anhydride, 1H,3H-Benzo[de]isochromene-1,3-dione, BRN 0153190

Molecular Formula: C12H6O3Molecular Weight: 198.174240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GRSMWKLPSNHDHA-UHFFFAOYSA-N

• 2'-Deoxyadenosine-5'-monophosphate
IUPAC Name: [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate | CAS Registry Number: 902-04-5
Synonyms: Deoxyguanylic acid, vernine, Deoxyguanylate, dGMP, guanine riboside, Deoxy-GMP, Poly dG, Deoxy GMP, Deoxyguanosine monophosphate, Poly(dG), 2'-Deoxy-GMP, 2'-Deoxyguanylic acid, 5'-Deoxyguanylic acid, deoxyguanosine-phosphate, Polydeoxyguanylic acid, DGP-DGP, 2'-Deoxyguanosine 5'MP, 2'-Deoxy-5'-guanylic acid, 2'-dGMP, 2'-Deoxyguanosine 5'-phosphate

Molecular Formula: C10H14N5O7PMolecular Weight: 347.221221 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 11

InChIKey: LTFMZDNNPPEQNG-KVQBGUIXSA-N

• 1-Octane Sulphonic Acid Sodium Salt
IUPAC Name: sodium octane-1-sulfonate | CAS Registry Number: 5324-84-5
Synonyms: Sodium octylsulfonate, Sodium octanesulfonate, Sodium 1-octanesulfonate, sodium octane-1-sulfonate, O0133_SIAL, O8380_SIAL, 1-Octanesulfonic acid, sodium salt, 74886_FLUKA, Sodium 1-octanesulfonate solution, 1-Octanesulfonic acid sodium salt, NSC 2738, EINECS 226-195-4, Sodium octane-1-sulphonate monohydrate, 163883-56-5, 3944-72-7

Molecular Formula: C8H17NaO3SMolecular Weight: 216.273550 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HRQDCDQDOPSGBR-UHFFFAOYSA-M

• (1R,2R,5R)-(+)-2-Hydroxy-3-pinanone
IUPAC Name: (1R,4R,5R)-4-hydroxy-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one | CAS Registry Number: 24047-72-1
Synonyms: (1R,2R,5R)-2-hydroxy-3-pinanone, PubChem18156, AC1O6JRR, (+)-2-Hydroxypinocamphone, SureCN1171547, (+)-2|A-Hydroxy-3-pinanone, CTK8B1279, MolPort-009-198-943, ANW-25308, ZINC00389859, AKOS015855447, (+)-2|A-Hydroxy-10|A-pinan-3-one, AK-34297, KB-00439, (+)-(1R,2R,5R)-2-Hydroxy-3-pinanone, FT-0604408, H0862, I14-10179, [1R-(1|A,2|A.,5|A)]- (+)-2-Hydroxy-3-pinanone, (1R,4R,5R)-4-hydroxy-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one

Molecular Formula: C10H16O2Molecular Weight: 168.232840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VZRRCQOUNSHSGB-BRDIYROLSA-N

• (+)-B-Hydrastine Hcl
IUPAC Name: (3S)-6,7-dimethoxy-3-[(5R)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-2-benzofuran-1-one hydrochloride | CAS Registry Number: 5936-28-7
Synonyms: Hydrastine hydrochloride, Hydrastine HCl, Prestwick_262, beta-Hydrastine hydrochloride, UNII-562PDC2I9K, MLS002153888, EINECS 227-692-9, CID197834, LS-76348, SMR001233238

Molecular Formula: C21H22ClNO6Molecular Weight: 419.855480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: URBFHJWLYXILMP-VOMIJIAVSA-N

• 1-Nitroso-2-naphthol
IUPAC Name: 1-nitrosonaphthalen-2-ol | CAS Registry Number: 131-91-9
Synonyms: 2-Naphthol, 1-nitroso-, 2-Naphthalenol, 1-nitroso-, Nitroso-beta-naphthol, .alpha.-Nitrosonaphthol, Nitroso-.beta.-naphthol, Zelen moridlova 4 [Czech], 1-Nitroso-2-naftol [Czech], CCRIS 1556, WLN: L66J BNO CQ, 1,2-Naphthoquinone 1-oxime, 1,2-Naphthoquinone, 1-oxime, 114693_ALDRICH, alpha-Nitroso-beta-naftol [Czech], 1,2-Naphthalenedione, 1-oxime, NSC 4151, EINECS 205-043-0, .alpha.-Nitroso-.beta.-naphthol, 1-NITROSO-2-NAPHTHALENOL, NSC4151, NSC677525

Molecular Formula: C10H7NO2Molecular Weight: 173.168080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YXAOOTNFFAQIPZ-UHFFFAOYSA-N

• 1-Aminobenzotriazole
IUPAC Name: benzotriazol-1-amine | CAS Registry Number: 1614-12-6
Synonyms: 1-aminobenzotriazole, 1-Abtz, 1-Benzotriazolamine, 1H-Benzotriazol-1-amine, Lopac-A-3940, Lopac0_000056, MLS001056764, A3940_SIGMA, 1H-1,2,3-Benzotriazol-1-amine, 07035_FLUKA, 1H-1,2,3-Benzotriazol-1-ylamine, NSC656987, AIDS141419, NSC 114498, AIDS-141419, NSC114498, SBB004208, ZINC00230381, NCGC00015056-01, NCGC00093570-01

Molecular Formula: C6H6N4Molecular Weight: 134.138640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JCXKHYLLVKZPKE-UHFFFAOYSA-N

• 2,4-Diamino-6-Hydroxy Pyrimidine
IUPAC Name: 2,6-diamino-1H-pyrimidin-4-one | CAS Registry Number: 56-06-4
Synonyms: 2,6-Diamino-4-pyrimidinol, 2,4-Diamino-6-hydroxypyrimidine, 2,4-Diaminohypoxanthine, Tocris-0476, 2,6-Diamino-4-pyrimidinone, 2,6-Diamino-4-hydroxypyrimidine, 4(1H)-Pyrimidinone, 2,6-diamino-, Lopac-D1920-6, 2,6-diaminopyrimidin-4-ol, Lopac0_000419, C4H6N4O, D19206_ALDRICH, MLS002153230, NSC9302, 2,4-DAHP, 2,6-Diamino-1H-pyrimidin-4-one, DHAP-2,4, NSC 9302, 33050_FLUKA, EINECS 200-254-4

Molecular Formula: C4H6N4OMolecular Weight: 126.116640 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: SWELIMKTDYHAOY-UHFFFAOYSA-N

• 1-Fluoronaphthalene
IUPAC Name: 1-fluoronaphthalene | CAS Registry Number: 321-38-0
Synonyms: Naphthalene, 1-fluoro-, 1-FLUORONAPHTHALENE, Fluoronaphthalene, alpha-Fluoronaphthalene, .alpha.-Fluoronaphthalene, 1-Fluornaftalen [Czech], WLN: L66J BF, 196657_ALDRICH, 442266_SUPELCO, NSC 4690, EINECS 206-287-0, NSC4690, JRD-1263, BRN 1906413, LS-94702, TL8002443, 4-05-00-01657 (Beilstein Handbook Reference), InChI=1/C10H7F/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7

Molecular Formula: C10H7FMolecular Weight: 146.160983 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CWLKTJOTWITYSI-UHFFFAOYSA-N

• 16,17-alpha Epoxypregnenolone
Synonyms: NSC122401, 16.alpha.,17.alpha.-Epoxypregnenolone, 16.alpha.,17.alpha.-Oxidopregnenolone, BAS 00513842, ST5232949, Pregn-5-en-20-one, 16.alpha.,17-epoxy-3.beta.-hydroxy-, 16.alpha.,17-Epoxy-3.beta.-hydroxypregn-5-en-20-one, 5-Pregnen-16.alpha.,17.alpha.-epoxy-3.beta.-ol-20-one, 16.alpha.,17.alpha.-Epoxy-3.beta.-hydroxy-5-pregnen-20-one, 3.beta.-Hydroxy-16.alpha.,17.alpha.-epoxy-5-pregnen-20-one, Pregn-5-en-20-one, 16,17-epoxy-3-hydroxy-, (3.beta.,16.alpha.)-

Molecular Formula: C21H30O3Molecular Weight: 330.461100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UQVIXFCYKBWZPJ-UHFFFAOYSA-N

• 2,2,3,3-Tetrafluoropropanol
IUPAC Name: 2,2,3,3-tetrafluoropropan-1-ol | CAS Registry Number: 76-37-9
Synonyms: Tetrafluoropropyl alcohol, 2,2,3,3-Tetrafluoro-1-propanol, WLN: Q1XFFYFF, 2,2,3,3-Tetrafluoropropyl alcohol, NSC 113, 1,1,3-Trihydroperfluoro-1-propanol, 326275_ALDRICH, NSC113, 1-Propanol, 2,2,3,3-tetrafluoro-, 1H,1H,3H-Tetrafluoro-1-propanol, 2,2,3,3-Tetrafluoropropan-1-ol, 87270_FLUKA, EINECS 200-955-5, CID6441, 2,2,3,3-TETRAFLUOROPROPANOL, BB_SC-0393, BRN 1738264, ZINC01555301, AI3-23784, T107

Molecular Formula: C3H4F4OMolecular Weight: 132.056873 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: NBUKAOOFKZFCGD-UHFFFAOYSA-N

• 1,3-Diethyl-2-thiobarbituric acid
IUPAC Name: 1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione | CAS Registry Number: 5217-47-0
Synonyms: 1,3-Diethylthiobarbituric acid, N,N'-Diethylthiobarbituric acid, N,N'-Diethyl-2-thiobarbituric acid, 161950_ALDRICH, EINECS 226-010-7, Barbituric acid, 1,3-diethyl-2-thio-, NSC 158284, NSC158284, ZINC00119654, LS-184944, ST5308641, 4,6(1H,5H)-Pyrimidinedione, 1,3-diethyldihydro-2-thioxo-, Barbituric acid, 1,3-diethyl-2-thio- (8CI), 1,3-diethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1,3-Diethyldihydro-2-thioxopyrimidine-4,6(1H,5H)-dione, 61732-60-3

Molecular Formula: C8H12N2O2SMolecular Weight: 200.258080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SHBTUGJAKBRBBJ-UHFFFAOYSA-N

• 1,2:5,6-Di-O-Isopropylidene-Alpha-D-Ribo-3-Hexulofuranose
IUPAC Name: 5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-6-one | CAS Registry Number: 2847-00-9
Synonyms: NSC623655, AIDS131381, AIDS-131381, CID360941, 5-(2,2-Dimethyl-[1,3]dioxolan-4-yl)-2,2-dimethyl-dihydro-furo[2,3-d][1,3]dioxol-6-one

Molecular Formula: C12H18O6Molecular Weight: 258.267720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: QSRFRZJIRAOQSJ-UHFFFAOYSA-N

• (1S)-(-)-beta-Pinene
IUPAC Name: (1S,5S)-7,7-dimethyl-4-methylidenebicyclo[3.1.1]heptane | CAS Registry Number: 18172-67-3
Synonyms: (-)-beta-Pinene, (-)-nopinene, beta-PINENE, 90% +, W290300_ALDRICH, (−)-beta-Pinene, 112089_ALDRICH, 402753_ALDRICH, (-)-(1S,5S)-beta-pinene, (-)-Pin-2(10)-ene, STOCK1N-18066, 80609_FLUKA, CHEBI:28359, (1S,5S)-2(10)-Pinene, (1S,5S)-pin-2(10)-ene, CPD-4891, LMPR01020044, ZINC01530385, (1S)-(−)-beta-Pinene, (1S,5S)-6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptane, C06307

Molecular Formula: C10H16Molecular Weight: 136.234040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WTARULDDTDQWMU-IUCAKERBSA-N

• 1,3-Dihydro-1-(1,2,3,6-tetrahydro-4-pyridinyl)-2H-benzimidazole-2-one
IUPAC Name: 3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-benzimidazol-2-one | CAS Registry Number: 2147-83-3
Synonyms: MLS000737175, MLS001359872, NSC88883, CID75070, EINECS 218-415-2, SBB003398, SMR000528403, 1,3-Dihydro-1-(1,2,3,6-tetrahydro-4-pyridinyl)-2H-benzimidazol-2-one

Molecular Formula: C12H13N3OMolecular Weight: 215.251120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YFEOSTXFQCDCAR-UHFFFAOYSA-N

• 2,5-Dihydroxy Acetophenone
IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone | CAS Registry Number: 490-78-8
Synonyms: Quinacetophenone, 2-Acetylhydroquinone, Acetylhydroquinone, Acetylquinol, 2,5-Dihydroxyacetophenone, Acetophenone, 2',5'-dihydroxy-, 2',5'-DIHYDROXYACETOPHENONE, Ethanone, 1-(2,5-dihydroxyphenyl)-, WLN: QR CQ BV1, 1-(2,5-Dihydroxyphenyl)ethanone, ghl.PD_Mitscher_leg0.355, D107603_ALDRICH, 2-Acetyl-1,4-dihydroxybenzene, NSC 3759, 89415_FLUKA, EINECS 207-716-4, NSC3759, 2,5-Dihydroxyphenyl methyl ketone, BRN 0637903, ZINC00164902

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WLDWSGZHNBANIO-UHFFFAOYSA-N

• 1-Hexane Sulphonic Acid Sodium Salt
IUPAC Name: sodium hexane-1-sulfonate | CAS Registry Number: 2832-45-3
Synonyms: Sodium hexanesulfonate, H5269_SIAL, H9026_SIAL, 52864_FLUKA, Sodium 1-hexanesulfonate solution, 1-Hexanesulfonic acid sodium salt, 1-Hexanesulfonic acid, sodium salt, 317411_SIAL, EINECS 220-601-3, Sodium hexane-1-sulphonate monohydrate, 163883-55-4

Molecular Formula: C6H13NaO3SMolecular Weight: 188.220390 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QWSZRRAAFHGKCH-UHFFFAOYSA-M

• 1,1'-bis(diphenylphosphino)ferrocene
IUPAC Name: cyclopenta-2,4-dien-1-yl(diphenyl)phosphane; iron | CAS Registry Number: 12150-46-8
Synonyms: NSC238923

Molecular Formula: C34H20FeP2-10Molecular Weight: 546.315122 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: KNVAAITVNCIMBM-UHFFFAOYSA-N

• 2-Bromo Nitrobenzene
IUPAC Name: 1-bromo-2-nitrobenzene | CAS Registry Number: 577-19-5
Synonyms: 1-Bromo-2-nitrobenzene, o-Nitrobromobenzene, 2-Bromonitrobenzene, 2-Nitrobromobenzene, O-BROMONITROBENZENE, Benzene, 1-bromo-2-nitro-, o-Nitrophenyl bromide, Ambap5905, O-BROMONITROBENZINE, CCRIS 3113, ghl.PD_Mitscher_leg0.917, 273961_ALDRICH, 365424_ALDRICH, 17690_FLUKA, EINECS 209-409-0, UN2732, AIDS019388, NSC 403836, AIDS-019388, CID11341

Molecular Formula: C6H4BrNO2Molecular Weight: 202.005460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ORPVVAKYSXQCJI-UHFFFAOYSA-N


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