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Chempure

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Profile: Chempure is involved in the business of chemicals. We provide bio-chemical, fine, organic and specialty research chemicals. Our products include abietic acid, 2-cis-4-trans-abscisic acid, 2-acetamido-5-aminopyridine, 2-amino-4-chloro-6-methylpyrimidine, barium acetate, barium bromate, cadmium carbonate, cadmium sulfate octahydrate, 3-decanone, 2,5-difluorotoluene, 3,4-(ethylenedioxy)benzeneboronic acid and 3-ethyl-3-hexanol.

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• 1,3-Di(4-piperidyl)propane 4,4-Trimethyiene piperidinopiperidine
IUPAC Name: 4-(3-piperidin-4-ylpropyl)piperidine | CAS Registry Number: 16898-52-5
Synonyms: DI-PIP, Piperid Pr-bis deriv., 4,4'-Trimethylenedipiperidine, 1,3-Di-4-piperidylpropane, Maybridge4_003634, 1,3-Bis(4-piperidyl)propane, Oprea1_445285, Piperidine, 4,4'-trimethylenedi-, 1,3-Di(4-Piperidyl)propane, 121207_ALDRICH, Piperidine, 4,4'-(1,3-propanediyl)bis-, AIDS006073, 4,4'-(1,3-Propanediyl)bispiperidine, AIDS-006073, NSC96364, EINECS 240-941-6, NSC 96364, 1,3-BIS-4-PIPERIDYL PROPANE, 4,4'-(1,3-Propanediyl)bis(piperidine), Piperidine, 4,4'-trimethylenedi- (8CI)

Molecular Formula: C13H26N2Molecular Weight: 210.358940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OXEZLYIDQPBCBB-UHFFFAOYSA-N

• 1,1-diphenyl-2-propyn-1-ol
IUPAC Name: 1,1-di(phenyl)prop-2-yn-1-ol | CAS Registry Number: 3923-52-2
Synonyms: Diphenylethinylcarbinol, Diphenylethynylcarbinol, Ethynyldiphenylmethanol, 1,1-Diphenyl-2-propyn-1-ol, 1,1-Diphenylpropargyl alcohol, Diphenyl ethynyl carbinol, 1,1-diphenylprop-2-yn-1-ol, 2-Propyn-1-ol, 1,1-diphenyl-, 477443_ALDRICH, 3,3-Diphenyl-3-hydroxy-1-propyne, 43210_FLUKA, NSC 113228, BRN 0514549, NSC113228, SBB008737, ZINC01704130, Benzenemethanol, alpha-ethynyl-alpha-phenyl-, D150, LS-30747, 2-Propyn-1-ol, 1,1-diphenyl- (8CI)

Molecular Formula: C15H12OMolecular Weight: 208.255180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SMCLTAARQYTXLW-UHFFFAOYSA-N

• 4-(Cyclohexen-1-yl)morpholine
IUPAC Name: 4-cyclohexen-1-ylmorpholine | CAS Registry Number: 670-80-4
Synonyms: 1-Morpholinocyclohexene, N-Morpholino-1-cyclohexene, 1-Morpholin-1-ylcyclohexene, Cyclohexanone morpholine enamine, 1-(N-Morpholino)cyclohexene, 4-(1-Cyclohexen-1-yl)morpholine, 4-(1-Cyclohexenyl)morpholine, 1-Morpholino-1-cyclohexene, Morpholine, 4-(1-cyclohexen-1-yl)-, 1(1-Cyclohexenyl)morpholine, M87800_ALDRICH, 4-Cyclohex-1-enyl-morpholine, 4-cyclohex-1-en-1-ylmorpholine, N-(Cyclohex-1-en-1-yl)morpholine, NSC42450, EINECS 211-579-6, NSC 42450, MORPHOLINE,4-(1-CYCLOHEXENE), ST5211419, TL8004732

Molecular Formula: C10H17NOMolecular Weight: 167.248080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IIQFBBQJYPGOHJ-UHFFFAOYSA-N

• 1,2,4-Benzenetricarboxylic Acid
IUPAC Name: benzene-1,2,4-tricarboxylic acid | CAS Registry Number: 528-44-9
Synonyms: TRIMELLITIC ACID, 1,2,4-Benzenetricarboxylic acid, 4-Carboxyphthalic acid, 1,2,4-Tricarboxybenzene, WLN: QVR BVQ DVQ, 1,3,4-Benzenetricarboxylic acid, 1,4,5-Benzenetricarboxylic acid, B4589_ALDRICH, Benzene-1,2,4-tricarboxylic acid, 92119_FLUKA, EINECS 208-432-3, CHEBI:166055, NSC 72986, CID10708, NSC72986, BRN 2214815, BBV-266549, NCGC00164021-01, LS-32230, EU-0066742

Molecular Formula: C9H6O6Molecular Weight: 210.140340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: ARCGXLSVLAOJQL-UHFFFAOYSA-N

• 1,3,5-trichloro-2-iodobenzene
IUPAC Name: 1,3,5-trichloro-2-iodobenzene | CAS Registry Number: 6324-50-1
Synonyms: NSC29082, CID232054, TL 00270

Molecular Formula: C6H2Cl3IMolecular Weight: 307.343550 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: XXFFSBRDPQFIPO-UHFFFAOYSA-N

• (4-Chlorophenylthio)propan-2-one
IUPAC Name: 1-(4-chlorophenyl)sulfanylpropan-2-one | CAS Registry Number: 25784-83-2
Synonyms: (4-Chlorophenylthio)acetone, 653594_ALDRICH, NSC274960, ZINC00156560, 1-[(4-Chlorophenyl)thio]-2-propanone, ST5410482

Molecular Formula: C9H9ClOSMolecular Weight: 200.685160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VIUDWXCHYJJHLD-UHFFFAOYSA-N

• (2-Chloroethyl)triphenylphosphonium bromide
IUPAC Name: 2-chloroethyl(triphenyl)phosphanium bromide | CAS Registry Number: 31238-20-7
Synonyms: EINECS 250-527-7, CID3084530, 2-Chloroethyltriphenylphosphonium bromide

Molecular Formula: C20H19BrClPMolecular Weight: 405.695621 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HETXOZDAMZALJQ-UHFFFAOYSA-M

• (S)-N-Benzyl-3-Acetylamino Pyrrolidine
IUPAC Name: N-(1-benzylpyrrolidin-3-yl)acetamide | CAS Registry Number: 114636-30-5
Synonyms: 1-Benzyl-3-acetamidopyrrolidine, 28506-01-6, N-Benzyl-3-(Acetylamino)pyrrolidine, N-(1-benzylpyrrolidin-3-yl)acetamide, ACMC-20abrp, PubChem11218, ACMC-20api0, AC1N5OHN, ACMC-1CH1T, SureCN7393471, 3-Acetamido-1-benzylpyrrolidine, AGN-PC-000G51, CTK4G1610, ANW-26408, AKOS009071485, AG-E-91620, MCULE-3793424645, KB-152205, B1355, FT-0607395

Molecular Formula: C13H18N2OMolecular Weight: 218.294820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CMSWETNAAPYFSH-UHFFFAOYSA-N

• 1,6-Dibromo-2-hydroxynaphthalene-3-carboxylic acid
IUPAC Name: 4,7-dibromo-3-hydroxynaphthalene-2-carboxylic acid | CAS Registry Number: 1779-10-8
Synonyms: 638528_ALDRICH, NSC8508, NSC 8508, NSC50642, EINECS 217-214-7, NSC 50642, 2-Naphthoic acid, 4,7-dibromo-3-hydroxy-, 4,7-Dibromo-3-hydroxy-2-naphthoic acid, 2-Naphthalenecarboxylic acid, 4,7-dibromo-3-hydroxy-

Molecular Formula: C11H6Br2O3Molecular Weight: 345.971540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNMKUIQCIRAXBN-UHFFFAOYSA-N

• 1-tetradecyne
IUPAC Name: tetradec-1-yne | CAS Registry Number: 765-10-6
Synonyms: 1-Tetradecyne, Tetradecyne, 87197_FLUKA, CID69823, EINECS 212-139-6, SBB008951, 1-C14H26, TL8005230

Molecular Formula: C14H26Molecular Weight: 194.356240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DZEFNRWGWQDGTR-UHFFFAOYSA-N

• (R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine
IUPAC Name: (1R)-1,2,3,4-tetrahydronaphthalen-1-amine | CAS Registry Number: 23357-46-2
Synonyms: (R)-1,2,3,4-Tetrahydro-1-naphthylamine, (R)-1,2,3,4-tetrahydronaphthalen-1-amine, (R)-(-)-1-Aminotetraline, AG-E-68011, (R)-1, 2, 3, 4-tetrahydro-1-naphthylamine, (1R)-1,2,3,4-tetrahydronaphthalen-1-amine, AC1OEJUJ, PubChem13011, SureCN469047, AC1Q4U9U, 668818_ALDRICH, CHEMBL289966, CTK4F1344, (R)-(-)-1-AminoTetralin(R), CHEBI:159189, MolPort-003-986-641, (R)-(-)-1-AminoTetralin®, ANW-70714, AM62763, AK105266

Molecular Formula: C10H13NMolecular Weight: 147.216920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JRZGPXSSNPTNMA-SNVBAGLBSA-N

• 1-(2,3-Dichlorophenyl)piperazine hydrochloride
IUPAC Name: 1-(2,3-dichlorophenyl)piperazine;hydrochloride | CAS Registry Number: 119532-26-2
Synonyms: 41202-77-1, 1-(2,3-Dichlorophenyl)piperazine monohydrochloride, SBB003054, 1-(2,3-Dichlorophenyl)-piperazine hydrochloride, 1-(2,3-dichlorophenyl)-piperazine monohydrochloride, (2,3-dichlorophenyl)piperazine, chloride, zlchem 392, PubChem8589, SureCN246338, AGN-PC-00D0JT, ACMC-209a34, 679135_ALDRICH, CTK0H4814, ZLC0238, MolPort-001-769-710, ACN-S002575, ACN-S002576, ACT02157, ANW-17342, FC0193

Molecular Formula: C10H13Cl3N2Molecular Weight: 267.582620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CYQFNNSFAGXCEC-UHFFFAOYSA-N

• 1-Phenylisatin
IUPAC Name: 1-phenylindole-2,3-dione | CAS Registry Number: 723-89-7
Synonyms: 1-Phenyl-indole-2,3-dione, Isatin-based compound, 13, MLS000521345, 1-Phenyl-1H-indole-2,3-dione, 1H-Indole-2,3-dione, 1-phenyl-, INDOLE-2,3-DIONE, 1-PHENYL-, 349119_ALDRICH, NSC 100013, BRN 0164531, NSC100013, ZINC01657403, 6L-325S, LS-83042, SMR000131753, 1H-Indole-2,3-dione, 1-phenyl- (9CI), EU-0033322, 5-21-10-00247 (Beilstein Handbook Reference)

Molecular Formula: C14H9NO2Molecular Weight: 223.226760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UWCPWBIMRYXUOU-UHFFFAOYSA-N

• 1-Bromoperfluoroheptane
IUPAC Name: 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane | CAS Registry Number: 375-88-2
Synonyms: Perfluoroheptyl bromide, Perfluoro-n-heptyl bromide, 1-Bromopentadecafluoroheptane, CID67819, EINECS 206-799-4, Heptane, 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro-

Molecular Formula: C7BrF15Molecular Weight: 448.954948 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 15

InChIKey: VPQQZKWYZYVTMU-UHFFFAOYSA-N

• 4-Bromophenyl trifluoromethyl sulphide
IUPAC Name: 1-bromo-4-(trifluoromethylsulfanyl)benzene | CAS Registry Number: 333-47-1
Synonyms: 555495_ALDRICH, ZINC00158098, 4-(Trifluoromethylthio)bromobenzene, CID736413, ST5306932

Molecular Formula: C7H4BrF3SMolecular Weight: 257.070870 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CQQBVMXLTBXNLB-UHFFFAOYSA-N

• 1,3-CyclohexaneDione
IUPAC Name: cyclohexane-1,3-dione | CAS Registry Number: 504-02-9
Synonyms: Dihydroresorcinol, 1,3-Cyclohexanedione, Hydroresorcinol, 1,3-Cyclohexanone, Resorcinol, dihydro-, 1,3-Cyclohexandione, 1,3 Cyclohexanedione, CYCLOHEXANE-1,3-DIONE, 1,3-Benzenediol, dihydro-, WLN: L6V CVTJ, Benzil-related compound, 49, CYCLOHEXANE-13-DIONE, C101605_ALDRICH, 29059_FLUKA, CHEBI:17766, CID10434, NSC57477, EINECS 207-980-0, NSC 57477, SB 01019

Molecular Formula: C6H8O2Molecular Weight: 112.126520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HJSLFCCWAKVHIW-UHFFFAOYSA-N

• (-)-DIOP
IUPAC Name: [5-[di(phenyl)phosphanylmethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-di(phenyl)phosphane | CAS Registry Number: 32305-98-9
Synonyms: NSC699412, AIDS153218, AIDS-153218, EINECS 250-984-2, NCI60_035591, (-)-2,2-Dimethyl-4,5-((diphenylphosphino)dimethyl)dioxolane, (+)-2,3-O-Isopropylidene-2,3-dihydroxy-1,4-bis(diphenylphosphino)butane, 2,3,O-Isopropylidene-2,3-dihydroxy-1,4-bis(diphenylphosphino)butane, ((5-((Diphenylphosphino)methyl)-2,2-dimethyl-1,3-dioxolan-4-yl)methyl)(diphenyl)phosphine, (-)-1,4-Bis(diphenylphosphino)-1,4-dideoxy-2,3-O-isopropylidene-L-threitol, Phosphine, [(2,2-dimethyl-1,3-dioxolane-4,5-diyl)bis(methylene)]bis[diphenyl-, (4S-trans)-

Molecular Formula: C31H32O2P2Molecular Weight: 498.532102 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VCHDBLPQYJAQSQ-UHFFFAOYSA-N

• 1,3-Dibenzoylbenzene
IUPAC Name: [3-(benzoyl)phenyl]-phenylmethanone | CAS Registry Number: 3770-82-9
Synonyms: m-Dibenzoylbenzene, m-DIBENZOYL BENZENE, MLS001360016, 392057_ALDRICH, NSC631642, AIDS069017, AIDS-069017, NSC43091, EINECS 223-210-6, Methanone, 1,3-phenylenebis(phenyl-, Methanone, 1,3-phenylenebis[phenyl-, NSC 43091, SBB007917, ZINC01675861, FR-0578, NCI60_010378, SMR001224328, InChI=1/C20H14O2/c21-19(15-8-3-1-4-9-15)17-12-7-13-18(14-17)20(22)16-10-5-2-6-11-16/h1-14

Molecular Formula: C20H14O2Molecular Weight: 286.323960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MJQHDSIEDGPFAM-UHFFFAOYSA-N

• 1,2,4-Triacetoxybenzene
IUPAC Name: (2,5-diacetyloxyphenyl) acetate | CAS Registry Number: 613-03-6
Synonyms: Pyrogallol A, Hydroxyhydroquinone triacetate, 1,2,4-Benzenetriacetate, 1,2,4-Benzenetriol, triacetate, 2-Hydroxyhydroquinone triacetate, 1,2,4-Tri-acetoxybenzene, 1,2,4-Benzenetriol triacetate, 1,2,4-Phenenyl triacetate, Benzene-1,2,4-triyl triacetate, 132039_ALDRICH, NSC 2149, EINECS 210-327-2, NSC2149, 2,4-Bis(acetyloxy)phenyl acetate, CID69169, BRN 2138876, ZINC00056433, Triacetate d'hydroxyhydroquinone [French], AI3-17879, LS-32273

Molecular Formula: C12H12O6Molecular Weight: 252.220080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: AESFGSJWSUZRGW-UHFFFAOYSA-N

• 1,4-diethoxybenzene
IUPAC Name: 1,4-diethoxybenzene | CAS Registry Number: 122-95-2
Synonyms: p-Diethoxybenzene, 1,4-Diethoxybenzene, Benzene, p-diethoxy-, Benzene, 1,4-diethoxy-, Hydroquinone diethyl ether, Hydroquinone diethylether, Benzene, p-diethoxy- (8CI), 544213_ALDRICH, NSC2113, NSC 2113, NSC68808, EINECS 204-585-5, ZINC00394919, AI3-09458, ST5406047, InChI=1/C10H14O2/c1-3-11-9-5-7-10(8-6-9)12-4-2/h5-8H,3-4H2,1-2H

Molecular Formula: C10H14O2Molecular Weight: 166.216960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VWGNFIQXBYRDCH-UHFFFAOYSA-N

• 1-Bromo-4-butylbenzene
IUPAC Name: 1-bromo-4-butylbenzene | CAS Registry Number: 41492-05-1
Synonyms: 4-Bromo-n-butylbenzene, 1-Bromo-4-n-Butylbenzene, ST50405192, 4-n-Butylbromobenzene, PubChem15109, ACMC-209jkm, AC1LAV2E, AC1Q2VDY, 1-(4-Bromophenyl)butane, SureCN687846, 1-Bromo-4-ButYl-Benzene, 4-(But-1-yl)bromobenzene, KSC106O7D, 335762_ALDRICH, 1-Bromo-4-(but-1-yl)benzene, MolPort-001-759-142, ANW-29636, ZINC02390036, AKOS005256901, LS11195

Molecular Formula: C10H13BrMolecular Weight: 213.114220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BRGVKVZXDWGJBX-UHFFFAOYSA-N

• 1H,1H,5H-Octafluoropentyl acrylate
IUPAC Name: 2,2,3,3,4,4,5,5-octafluoropentyl prop-2-enoate | CAS Registry Number: 376-84-1
Synonyms: 474401_ALDRICH, EINECS 206-816-5, 2,2,3,3,4,4,5,5-Octafluoropentyl acrylate, LS-192524, 2-Propenoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester

Molecular Formula: C8H6F8O2Molecular Weight: 286.119266 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: WISUNKZXQSKYMR-UHFFFAOYSA-N

• (Tert-Buloxycarbonylmethyl)Triphenylphosphonium Chloride
IUPAC Name: [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-triphenylphosphanium;chloride | CAS Registry Number: 35000-37-4
Synonyms: (tert-Butoxycarbonylmethyl)triphenylphosphonium chloride, AG-F-20240, ACMC-1AHM8, 20423_ALDRICH, 20423_FLUKA, CTK3J6430, AKOS015833185, FT-0605351, ST50408128, TL80073964, (BOC-METHYL)TRIPHENYLPHOSPHONIUM CHLORIDE, I14-115640, (Carboxymethyl)triphenylphosphoniumchloride, tert-butyl ester (7CI); Phosphonium,[2-(1,1-dimethylethoxy)-2-oxoethyl]triphenyl-, chloride (9CI);(tert-Butoxycarbonylmethyl)triphenylphosphonium chloride

Molecular Formula: C24H26ClO2PMolecular Weight: 412.888802 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PWEGQXPODNSKMU-UHFFFAOYSA-M

• 1-BromoAdamantane
IUPAC Name: 1-bromoadamantane | CAS Registry Number: 768-90-1
Synonyms: 1-Bromoadamantane, Adamantyl bromide, 1-Adamantyl bromide, Adamantane, 1-bromo-, Maybridge1_002156, 1-BROMO ADAMANTANE, ADAMANTANE,1-BROMO, 109223_ALDRICH, 16130_FLUKA, EINECS 212-200-7, CID79106, 1-Bromotricyclo(3.3.1.13,7)decane, EINECS 230-777-3, NSC527914, 2-Bromotricyclo(3.3.1.13,7)decane, STT-00320130, LS-185689, ST5182329, TL8005279, Tricyclo[3.3.1.1(3,7)-]decane, 1-bromo-

Molecular Formula: C10H15BrMolecular Weight: 215.130100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VQHPRVYDKRESCL-UHFFFAOYSA-N

• (S)-4-Hydroxymethyl butyrolactone
IUPAC Name: 5-(hydroxymethyl)oxolan-2-one | CAS Registry Number: 32780-06-6
Synonyms: (S)-(+)-2',3'-Dideoxyribonolactone, 5-Hydroxymethyldihydrofuran-2-one, NSC128380, 5-(Hydroxymethyl)dihydro-2(3H)-furanone, NSC 128380, 2(3H)-Furanone, dihydro-5-(hydroxymethyl)-, 10374-51-3

Molecular Formula: C5H8O3Molecular Weight: 116.115220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NSISJFFVIMQBRN-UHFFFAOYSA-N

• 1-Methyl-2-piperidinemethanol
IUPAC Name: (1-methylpiperidin-2-yl)methanol | CAS Registry Number: 20845-34-5
Synonyms: 1-Methyl-2-hydroxymethylpiperidine, 155241_ALDRICH, STOCK1S-87958, NSC45464, EINECS 244-078-6

Molecular Formula: C7H15NOMolecular Weight: 129.200100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HXXJMMLIEYAFOZ-UHFFFAOYSA-N

• (R)-(-)-N-(Phenylsulphonyl)Glutamic Acid
IUPAC Name: (2S)-2-(benzenesulfonamido)pentanedioic acid | CAS Registry Number: 20531-36-6
Synonyms: AC1LXZ5A, SureCN698930, CTK1A1549, (-)-N-(Phenylsulfonyl)glutamic acid, AKOS010386358, L-Glutamic acid, N-(phenylsulfonyl)-, AG-E-50574, LT00454287, (2S)-2-(benzenesulfonamido)pentanedioic acid, Glutamic acid, N-(phenylsulfonyl)-,L- (8CI); N-(Phenylsulfonyl)-L-glutamicacid; N-Benzenesulfonyl-L-glutamic acid; N-Benzesulfonyl-L-glutamic acid

Molecular Formula: C11H13NO6SMolecular Weight: 287.289020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: PJLOGZZDKDUMFU-VIFPVBQESA-N

• 1,2,4-Trimethoxybenzene
IUPAC Name: 1,2,4-trimethoxybenzene | CAS Registry Number: 135-77-3
Synonyms: Benzene, 1,2,4-trimethoxy-, T68802_ALDRICH, EINECS 205-219-7, Hydroxyhydroquinone trimethyl ether, EPA Pesticide Chemical Code 040515, ZINC00391982, AI3-20797, NCGC00164023-01, LS-32250, ST5406125, TL8000835

Molecular Formula: C9H12O3Molecular Weight: 168.189780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AGIQIOSHSMJYJP-UHFFFAOYSA-N

• 1H-Perfluorohexane
IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluorohexane | CAS Registry Number: 355-37-3
Synonyms: EINECS 206-581-9, LS-186262, Trideca-1,1,1,2,2,3,3,4,4,5,5,6,6-fluorohexane, Hexane, 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-

Molecular Formula: C6HF13Molecular Weight: 320.051382 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 13

InChIKey: XJSRKJAHJGCPGC-UHFFFAOYSA-N

• 1-(Phenylsulfonyl)indole
IUPAC Name: 1-phenylsulfonylindole | CAS Registry Number: 40899-71-6
Synonyms: 1-(Phenylsulfonyl)-1H-indole, CBDivE_002895, MLS000104364, 366633_ALDRICH, ARONIS001276, IFLab1_005965, NSC683530, AIDS149292, AIDS-149292, NSC237040, IDI1_011368, SMR000054299, ST039848, AG-690/12868319

Molecular Formula: C14H11NO2SMolecular Weight: 257.307640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VDWLCYCWLIKWBV-UHFFFAOYSA-N

• 1-Chloro-2-iodo-1,1,2-trifluoroethane
IUPAC Name: 1-chloro-1,1,2-trifluoro-2-iodoethane | CAS Registry Number: 354-26-7
Synonyms: EINECS 206-553-6, 1-Chloro-1,1,2-trifluoro-2-iodoethane, Ethane, 1-chloro-1,1,2-trifluoro-2-iodo-

Molecular Formula: C2HClF3IMolecular Weight: 244.382020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XONGRFUEHPBOBB-UHFFFAOYSA-N

• 1,2-Dihydroxy methyl Benzene
IUPAC Name: [2-(hydroxymethyl)phenyl]methanol | CAS Registry Number: 612-14-6
Synonyms: 1,2-Benzenedimethanol, Phthalyl alcohol, o-Xylene-alpha,alpha'-diol, 1,2-phenylenedimethanol, 2-Hydroxymethylbenzenemethanol, 1,2-Bis(hydroxymethyl)benzene, 184829_ALDRICH, 12570_FLUKA, CID69153, EINECS 210-293-9, NSC403013, ZINC03861341, NSC 403013, AI3-19549, InChI=1/C8H10O2/c9-5-7-3-1-2-4-8(7)6-10/h1-4,9-10H,5-6H, 6680-73-5

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XMUZQOKACOLCSS-UHFFFAOYSA-N

• 1H,1H,5H-Octafluoropentyl methacrylate
IUPAC Name: 2,2,3,3,4,4,5,5-octafluoropentyl 2-methylprop-2-enoate | CAS Registry Number: 355-93-1
Synonyms: 470988_ALDRICH, EINECS 206-596-0, Octafluoropentyl methacrylate polymer, 2,2,3,3,4,4,5,5-Octafluoropentyl methacrylate, 2-Propenoic acid, 2-methyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester, 2-Propenoic acid, 2-methyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester, homopolymer, 30998-06-2

Molecular Formula: C9H8F8O2Molecular Weight: 300.145846 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: ZNJXRXXJPIFFAO-UHFFFAOYSA-N

• 1-Boc-2-Piperidone
IUPAC Name: tert-butyl 2-oxopiperidine-1-carboxylate | CAS Registry Number: 85908-96-9
Synonyms: ZINC05240121, ALBB-009361, CID7577838, tert-butyl 2-oxopiperidine-1-carboxylate, TL8005597, 1,1-Dimethylethyl 2-oxopiperidine-1-carboxylate

Molecular Formula: C10H17NO3Molecular Weight: 199.246880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ULMHMJAEGZPQRY-UHFFFAOYSA-N

• (-)-N-Formyl-L-Tert-Leucine
IUPAC Name: (2S)-2-formamido-3,3-dimethylbutanoic acid | CAS Registry Number: 92571-61-4
Synonyms: ST51016222, Valine, N-formyl-3-methyl-, AC1OC3GY, SCHEMBL2775611, CTK3F8039, WVCGTXBZDLZEDU-RXMQYKEDSA-N, 92571-58-9, AKOS024375456, (2S)-2-formamido-3,3-dimethylbutanoic acid, FT-0604402, (S)-2-Formylamino-3,3-dimethyl-butyric acid, (2S)-2-carbonylamino-3,3-dimethylbutanoic acid, I14-115479

Molecular Formula: C7H13NO3Molecular Weight: 159.183020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WVCGTXBZDLZEDU-RXMQYKEDSA-N

• 2-Bromo-4,6-difluoroiodobenzene
IUPAC Name: 1-bromo-3,5-difluoro-2-iodobenzene | CAS Registry Number: 175278-11-2
Synonyms: 1-Bromo-3,5-difluoro-2-iodobenzene, 3,5-difluoro-2-iodobromobenzene, PubChem3212, AC1LASDB, SureCN4607963, CTK4D5843, MolPort-000-151-920, ACT12689, ANW-72579, ZINC00167274, AKOS009157596, AG-E-25713, AM61370, AS03205, Benzene,1-bromo-3,5-difluoro-2-iodo-, AK-33728, Benzene, 1-bromo-3,5-difluoro-2-iodo-, KB-21258, FT-0611435, ST51051949

Molecular Formula: C6H2BrF2IMolecular Weight: 318.885356 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KJJGFGWQNCPZBG-UHFFFAOYSA-N

• (R)-1-Methyl-3-pyrrolidinol
IUPAC Name: (3R)-1-methylpyrrolidin-3-ol | CAS Registry Number: 104641-60-3
Synonyms: (R)-(-)-1-Methyl-3-pyrrolidinol, (R)-3-Hydroxy-1-methyl-pyrrolidine, (R)-(-)-1-Methyl-3-hydroxypyrrolidine, (3R)-1-methylpyrrolidin-3-ol, (R)-1-Methyl-pyrrolidin-3-ol, (R)-3-Hydroxy-1-methylpyrrolidine, AG-D-17109, (R)-(-)-3-Hydroxy-N-methylpyrrolidine, PubChem13969, AC1OCVM7, R-1MEHP, SureCN133294, (R)1-methyl-3-pyrrolidinol, (R)-1-methylpyrrolidin-3-ol, 647241_ALDRICH, Jsp000457, CTK4A3190, MolPort-001-768-440, ACN-S002117, ACT05087

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FLVFPAIGVBQGET-RXMQYKEDSA-N

• 2,5-dibromo nitrobenzene
IUPAC Name: 1,4-dibromo-2-nitrobenzene | CAS Registry Number: 3460-18-2
Synonyms: 2,5-Dibromonitrobenzene, 1,4-Dibromo-2-nitrobenzene, D42003_ALDRICH, Benzene, 1,4-dibromo-2-nitro-, ZINC02166805, CID77004, EINECS 222-404-8, ST5319426, TL8006912, T6039496

Molecular Formula: C6H3Br2NO2Molecular Weight: 280.901520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WRGKKASJBOREMB-UHFFFAOYSA-N

• 1,6-Dimethoxy naphthalene
IUPAC Name: 1,6-dimethoxynaphthalene | CAS Registry Number: 3900-49-0
Synonyms: 1,6-Dimethoxynaphthalene, Maybridge3_002840, 579254_ALDRICH, NSC167477, ZINC00160992, IDI1_014227, ST5408360

Molecular Formula: C12H12O2Molecular Weight: 188.222480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RBUFUWIWCCOVOS-UHFFFAOYSA-N

• 2,5-Dichlorofluorobenzene
IUPAC Name: 1,4-dichloro-2-fluorobenzene | CAS Registry Number: 348-59-4
Synonyms: Benzene,1,4-dichloro-2-fluoro-, Benzene, 1,4-dichloro-2-fluoro-, NSC10256, ST5405137, TL8002599

Molecular Formula: C6H3Cl2FMolecular Weight: 164.992423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BJQTYCQGIXZSNM-UHFFFAOYSA-N

• 2,2,3,3,4,4-Hexafluoro-1,5-pentanediol
IUPAC Name: 2,2,3,3,4,4-hexafluoropentane-1,5-diol | CAS Registry Number: 376-90-9
Synonyms: Hexafluoroamylene glycol, Hexafluoro-1,5-pentanediol, H8803_ALDRICH, 2,2,3,3,4,4-Hexafluoropentanediol, EINECS 206-819-1, NSC 29196, NSC29196, ZINC01652036, 1,5-Pentanediol, 2,2,3,3,4,4-hexafluoro-, 2,2,3,3,4,4-Hexafluoropentan-1,5-diol, 2,2,3,3,4,4-Hexafluoropentane-1,5-diol, LS-101661, 29713-13-1

Molecular Formula: C5H6F6O2Molecular Weight: 212.090359 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: IELVMUPSWDZWSD-UHFFFAOYSA-N

• (1R)-(-)-Menthyl Acetate
IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] acetate | CAS Registry Number: 2623-23-6
Synonyms: Menthyl acetate, L-Menthyl acetate, (-)-Menthyl acetate, (dl)-Menthyl acetate, Menthyl acetate, dl-, (+-)-Menthol acetate, (+-)-Menthyl acetate, L-p-Menth-3-yl acetate, p-Menth-3-yl acetate, dl-, (1R)-(-)-Menthyl acetate, W266825_ALDRICH, NSC3722, 441058_ALDRICH, NSC52970, 45985_FLUKA, 45990_FLUKA, CPD-5761, EINECS 201-911-8, EINECS 249-409-8, CID220674

Molecular Formula: C12H22O2Molecular Weight: 198.301880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XHXUANMFYXWVNG-ADEWGFFLSA-N

• (+/-)-Alpha-Methoxy-Alpha-Trifluoromethylphenylacetic Acid
IUPAC Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid | CAS Registry Number: 81655-41-6
Synonyms: MTPA, Mosher's acid, 3,3,3-Trifluoro-2-methoxy-2-phenylpropanoic acid, SBB000723, alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, (+/-)-1-methoxy-1-(trifluoromethyl)phenylacetic acid, [+]-MTPA, (+/-)-alpha-Methoxy-alpha-trifluoromethylphenylacetic acid, (+/-)-alpha-methoxy-alpha-(trifluoromethyl)phenylacetic acid, (+)-Mtpa, Benzeneacetic acid, alpha-methoxy-alpha-(trifluoromethyl)-, ACMC-20apjt, ACMC-20a3nm, Mosher's reagent [MI], AC1L3BQZ, (+/-)-Mosher's acid, SureCN236357, UNII-E015GCC0MA, (R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid, AC1Q44EE

Molecular Formula: C10H9F3O3Molecular Weight: 234.171870 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: JJYKJUXBWFATTE-UHFFFAOYSA-N

• 1-Thio-beta-D-glucose tetraacetate
IUPAC Name: [4,5-diacetyloxy-2-(acetyloxymethyl)-6-sulfanyloxan-3-yl] acetate | CAS Registry Number: 19879-84-6
Synonyms: NSC97032, .beta.-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate

Molecular Formula: C14H20O9SMolecular Weight: 364.368200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 9

InChIKey: SFOZKJGZNOBSHF-UHFFFAOYSA-N

• 1-Phenylpyrrole
IUPAC Name: 1-phenylpyrrole | CAS Registry Number: 635-90-5
Synonyms: N-Phenylpyrrole, Pyrrole, 1-phenyl-, 1H-Pyrrole, 1-phenyl-, 1-PHENYL-1H-PYRROLE, Pyrrole, 1-phenyl- (8CI), 131474_ALDRICH, 1H-Pyrrole, 1-phenyl- (9CI), AIDS019585, AIDS-019585, CID12480, NSC16581, EINECS 211-242-3, NSC 16581, STK197427, ZINC01519708, AI3-11735, TL8004441, P67003, InChI=1/C10H9N/c1-2-6-10(7-3-1)11-8-4-5-9-11/h1-9

Molecular Formula: C10H9NMolecular Weight: 143.185160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GEZGAZKEOUKLBR-UHFFFAOYSA-N

• 3-Aminopyrrolidine dihydrochloride
IUPAC Name: [(3R)-pyrrolidin-1-ium-3-yl]azanium | CAS Registry Number: 103831-11-4
Synonyms: ZINC04682891

Molecular Formula: C4H12N2+2Molecular Weight: 88.151480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: NGXSWUFDCSEIOO-SCSAIBSYSA-P

• 4-Bromo(trifluoromethoxy)benzene
IUPAC Name: 1-bromo-4-(trifluoromethoxy)benzene | CAS Registry Number: 407-14-7
Synonyms: 1-Bromo-4-(trifluoromethoxy)benzene, 339601_ALDRICH, p-Bromophenyl trifluoromethyl ether, 4-(Trifluoromethoxy)bromobenzene, JRD-0212, EINECS 206-979-2, SBB006606, ZINC00056737, TL806382, InChI=1/C7H4BrF3O/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4

Molecular Formula: C7H4BrF3OMolecular Weight: 241.005270 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SEAOBYFQWJFORM-UHFFFAOYSA-N

• 1,2,5,6,9,10-Hexabromocyclododecane
IUPAC Name: 1,2,5,6,9,10-hexabromocyclododecane | CAS Registry Number: 3194-55-6
Synonyms: Hexabromocyclododecane, HSDB 6110, 144762_ALDRICH, EINECS 221-695-9, 1,2,5,6,9,10-HEXABROMOCYCLODODECANE, 1,2,5,6,9,10-Hexabromocyclodecane, CID18529, Cyclododecane, 1,2,5,6,9,10-hexabromo-, NCGC00164063-01, LS-55963, 23774-70-1

Molecular Formula: C12H18Br6Molecular Weight: 641.695320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DEIGXXQKDWULML-UHFFFAOYSA-N

• 1-(3-Fluorophenyl)ethanol
IUPAC Name: 1-(3-fluorophenyl)ethanol | CAS Registry Number: 402-63-1
Synonyms: Ambap369, 3-Fluorophenylmethylcarbinol, NSC2996, 3-Fluoro-alpha-methylbenzyl alcohol, Benzenemethanol, 3-fluoro-.alpha.-methyl-, EINECS 206-950-4

Molecular Formula: C8H9FOMolecular Weight: 140.154863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YESOPGLEIJQAEF-UHFFFAOYSA-N

• (2s,3s)-(-)-2,3-Butanediol Di-P-Tosylate
IUPAC Name: [(2S,3S)-3-(4-methylphenyl)sulfonyloxybutan-2-yl] 4-methylbenzenesulfonate | CAS Registry Number: 74839-83-1
Synonyms: (-)-2,3-Butanediyl di(p-toluenesulfonate), (-)-2,3-Butanediol di-p-tosylate, 310522_ALDRICH, CTK8F1385, AG-G-97840, FT-0604669, 2,3-Butanediol,bis(4-methylbenzenesulfonate), [S-(R*,R*)]- (9CI)

Molecular Formula: C18H22O6S2Molecular Weight: 398.493680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: MFRBMNNZDFDJOF-HOTGVXAUSA-N


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