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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-Iododecane
IUPAC Name: 1-iododecane | CAS Registry Number: 2050-77-3
Synonyms: Decyl iodide, Decane, 1-iodo-, n-Decyl iodide, 1-IODODECANE, 238252_ALDRICH, EINECS 218-104-1, CID16314, BBV-266461, LS-59334

Molecular Formula: C10H21IMolecular Weight: 268.178210 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SKIDNYUZJPMKFC-UHFFFAOYSA-N

• 1-Adamantaneethanol
IUPAC Name: 2-(1-adamantyl)ethanol | CAS Registry Number: 6240-11-5
Synonyms: 2-(1-Adamantyl)ethanol, ChemDiv3_000222, Oprea1_402313, 188115_ALDRICH, EINECS 228-353-8, ZINC01271108, IDI1_019540, NCGC00177173-01, Tricyclo[3.3.1.1(3,7)-]decane-1-ethanol, ST5202977, EU-0033464, 2-(Tricyclo(3.3.1.1'3,7)dec-1-yl)ethanol

Molecular Formula: C12H20OMolecular Weight: 180.286600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ZBIDZPHRNBZTLT-UHFFFAOYSA-N

• 1-chloro-6-iodohexane
IUPAC Name: 1-chloro-6-iodohexane | CAS Registry Number: 34683-73-3
Synonyms: 1-Chloro-6-iodohexane, Hexamethylene chloroiodide, Hexane, 1-chloro-6-iodo-, 521582_ALDRICH, EINECS 252-144-0, CID118713

Molecular Formula: C6H12ClIMolecular Weight: 246.516950 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QTJHNJCILMMRIQ-UHFFFAOYSA-N

• 1,4-Bis(dimethylsilyl)benzene
IUPAC Name: [4-(dimethyl-$l^{3}-silanyl)phenyl]-dimethylsilicon | CAS Registry Number: 2488-01-9
Synonyms: p-Bis(dimethylsilyl)benzene, p-Bis(dimethysilyl)benzene, p-Phenylenebis(dimethylsilane), Silane, p-phenylenebis(dimethyl-, 1,4-Phenylenebis(dimethylsilane), EINECS 219-638-8, Silane, 1,4-phenylenebis(dimethyl-, BRN 1072658, Benzene, 1,4-bis(dimethylsilyl)-, CID6328729, LS-145233, 228860-42-2

Molecular Formula: C10H16Si2Molecular Weight: 192.405040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UHXCHUWSQRLZJS-UHFFFAOYSA-N

• (3-Bromo-2,4,6-Trimethylphenylcarbamoyl)Methyliminodiacetic Acid
IUPAC Name: 2-[[2-(3-bromo-2,4,6-trimethylanilino)-2-oxoethyl]-(carboxymethyl)amino]acetic acid | CAS Registry Number: 78266-06-5
Synonyms: Choletec, MEBROFENIN, Mebrofenine, Mebrofenino, Mebrofeninum, Mebrofenine [INN-French], Mebrofeninum [INN-Latin], Mebrofenino [INN-Spanish], Mebrofenin (USAN/INN), Mebrofenin [USAN:INN], UNII-7PV0B6ED98, EINECS 278-877-6, CID54158, SQ 26962, NCGC00181297-01, LS-72341, SQ-26962, D04869, ((((3-Bromomesityl)carbamoyl)methyl)imino)diacetic acid, Glycine, N-(2-((3-bromo-2,4,6-trimethylphenyl)amino)-2-oxoethyl)-N-(carboxymethyl)-

Molecular Formula: C15H19BrN2O5Molecular Weight: 387.225760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: MHPZZZZLAQGTHT-UHFFFAOYSA-N

• 1-(2-Tetrahydrofuroyl)piperazine
IUPAC Name: oxolan-2-yl(piperazin-1-yl)methanone | CAS Registry Number: 63074-07-7
Synonyms: 1-(2-Tetrahydrofuroyl)-piperazine, 1-(Tetrahydro-2-furoyl)piperazine, SBB005794, TL8004377

Molecular Formula: C9H16N2O2Molecular Weight: 184.235540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UKESBLFBQANJHH-UHFFFAOYSA-N

• 1,2-Dibenzoylbenzene
IUPAC Name: [2-(benzoyl)phenyl]-phenylmethanone | CAS Registry Number: 1159-86-0
Synonyms: o--Dibenzoyl benzene, ortho-Dibenzoylbenzene, 2-Benzoylbenzophenone, o-DIBENZOYLBENZENE, Maybridge4_002067, MLS000736538, MLS001181982, NSC6145, EINECS 214-597-2, Methanone, 1,2-phenylenebis(phenyl-, SBB008489, ZINC01036880, FR-2166, NCGC00176957-01, SMR000445964, SMR000567712

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

InChIKey: OJLABXSUFRIXFL-UHFFFAOYSA-N

• 1-Iodoundecane
IUPAC Name: 1-iodoundecane | CAS Registry Number: 4282-44-4
Synonyms: 1-IODOUNDECANE, Undecane, 1-iodo-, 280046_ALDRICH, LTBB004080, CID20276, AI3-23975, 146846-81-3

Molecular Formula: C11H23IMolecular Weight: 282.204790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FKUQOQPBCHJHAP-UHFFFAOYSA-N

• 1,2,4-tribromobenzene
IUPAC Name: 1,2,4-tribromobenzene | CAS Registry Number: 615-54-3
Synonyms: 1,2,4-TRIBROMOBENZENE, Benzene, 1,2,4-tribromo-, NCIOpen2_008043, 132756_ALDRICH, NSC62440, EINECS 210-433-9, NSC 62440, CID12002, AI3-18131, NCGC00164056-01, LS-32208, ST5405756, InChI=1/C6H3Br3/c7-4-1-2-5(8)6(9)3-4/h1-3

Molecular Formula: C6H3Br3Molecular Weight: 314.800020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FWAJPSIPOULHHH-UHFFFAOYSA-N

• 1-Chloroadamantane
IUPAC Name: 1-chloroadamantane | CAS Registry Number: 935-56-8
Synonyms: Adamantyl chloride, 3-Chloroadamantane, 1-Adamantyl chloride, Adamantane, 1-chloro-, Ambap735, ADAMANTANE,1-CHLORO, 294861_ALDRICH, Adamantane, 1-chloro- (8CI), CID64154, EINECS 213-305-0, NSC143629, NSC 143629, 1-Chlorotricyclo(3.3.1.13,7)decane, Tricyclo[3.3.1.13,7]decane, 1-chloro-, Tricyclo(3.3.1.13,7)decane, 1-chloro-, Tricyclo(3.3.1.1(3,7))decane, 1-chloro-, Tricyclo[3.3.1.1(3,7)]decane, 1-chloro-, Tricyclo[3.3.1.1<3,7>]decane, 1-chloro-, tricyclo[3.3.1.1~3,7~]decane, 1-chloro-, T0501-8649

Molecular Formula: C10H15ClMolecular Weight: 170.679100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: OZNXTQSXSHODFR-UHFFFAOYSA-N

• (R)-1-Phenyl-2-Propanol
IUPAC Name: (2R)-1-phenylpropan-2-ol | CAS Registry Number: 1572-95-8
Synonyms: (R)-1-Phenyl-2-propanol, (R)-(-)-1-Phenyl-2-propanol, (R)-1-Phenylpropan-2-ol, (2R)-1-phenylpropan-2-ol, (r)-(-)-phenyl-2-propanol, AC1NT5EI, SureCN98084, UNII-PLW3H4E008, (2R)-1-phenyl-2-propanol, 78926_ALDRICH, 78926_FLUKA, CTK4C9331, MolPort-003-939-071, Benzeneethanol, a-methyl-, (aR)-, ANW-21688, ZINC02046115, (R)-(-)-|A-Methylphenethyl alcohol, AKOS015840564, (R)-(-)-alpha-Methylphenethyl alcohol, AK-90116

Molecular Formula: C9H12OMolecular Weight: 136.190980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WYTRYIUQUDTGSX-MRVPVSSYSA-N

• 1,4-Di-N-Butylbenzene
IUPAC Name: 1,4-dibutylbenzene | CAS Registry Number: 1571-86-4
Synonyms: Benzene, 1,4-dibutyl, 1,4-Di-n-butylbenzene, Benzene, 1,4-dibutyl-, 1,4-Di-tert-butylbenzene, p-DI-tert-BUTYL BENZENE, CID519170

Molecular Formula: C14H22Molecular Weight: 190.324480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VGQOZYOOFXEGDA-UHFFFAOYSA-N

• 2,2,3,3-Tetrafluoro-1,4-butanediol
IUPAC Name: 2,2,3,3-tetrafluorobutane-1,4-diol | CAS Registry Number: 425-61-6
Synonyms: NCIOpen2_001518, 567191_ALDRICH, ZINC01615584, NSC95113, CID136270

Molecular Formula: C4H6F4O2Molecular Weight: 162.082853 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: CDZXJJOGDCLNKX-UHFFFAOYSA-N

• 1,4-bis-(trimethylsilylethynyl)benzene
IUPAC Name: trimethyl-[2-[4-(2-trimethylsilylethynyl)phenyl]ethynyl]silane | CAS Registry Number: 17938-13-5
Synonyms: 1,4-Bis[(trimethylsilyl)ethynyl]benzene, SBB009009, Trimethyl((4-[(trimethylsilyl)ethynyl]phenyl)ethynyl)silane, AC1LAWZO, ACMC-20ap2w, SureCN1306384, 462179_ALDRICH, CTK4D7259, MolPort-002-497-463, AKOS015914329, AG-A-10824, AG-E-29700, FT-0606807, V0495, Benzene,1,4-bis[2-(trimethylsilyl)ethynyl]-, 10.14272/CMTMWEXUJQSPCA-UHFFFAOYSA-N, doi:10.14272/CMTMWEXUJQSPCA-UHFFFAOYSA-N, I14-42235, trimethyl-[2-[4-(2-trimethylsilylethynyl)phenyl]ethynyl]silane, 4-[4-(3,3-dimethyl-3-silabut-1-ynyl)phenyl]-2,2-dimethyl-2-silabut-3-yne

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

InChIKey: CMTMWEXUJQSPCA-UHFFFAOYSA-N

• 1-tert-Butoxycarbonyl-3-hydroxy piperidine
IUPAC Name: tert-butyl 3-hydroxypiperidine-1-carboxylate | CAS Registry Number: 85275-45-2
Synonyms: 1-Boc-3-piperidinol, 1-Boc-3-hydroxypiperidine, 1-Boc-3-hydroxy-piperidine, 94647_FLUKA, Azacyclohexan-3-ol, 1t-butyloxycarbonyl-, MO 07159, tert-Butyl 3-hydroxy-1-piperidinecarboxylate

Molecular Formula: C10H19NO3Molecular Weight: 201.262760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UIJXHKXIOCDSEB-UHFFFAOYSA-N

• 2,2-Dibromo-1-Indanone
IUPAC Name: 2,2-dibromo-3H-inden-1-one | CAS Registry Number: 7749-02-2
Synonyms: 2,2-Dibromo-1-indanone, NSC128362, CID278630, ZINC00343167, 1H-Inden-1-one, 2,2-dibromo-2,3-dihydro-, AC-082/11576101

Molecular Formula: C9H6Br2OMolecular Weight: 289.951340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VGEJBODXYMOIGZ-UHFFFAOYSA-N

• 1-Naphthyl Acetate
IUPAC Name: naphthalen-1-yl acetate | CAS Registry Number: 830-81-9
Synonyms: 1-Naphthyl acetate, alpha-Naphthyl acetate, 1-Naphthol, acetate, a-Naphthyl acetate, 1-Acetoxynaphthalene, Naphthyl acetate, 1-Naphthylacetate, 1-Naphthyl a, alpha-Naphthol acetate, Naphthalene, 1-acetoxy-, alpha-Acetoxynaphthalene, Naphthalenol, acetate, 1-NAPHTHALENOL, ACETATE, .alpha.-Naphthyl acetate, Acetic acid 1-naphthyl ester, 1-Naphthalenol, 1-acetate, ALPHA-NAPHTHYL-ACETATE, 916_SIGMA, N8505_SIGMA, alpha-Naphthyl acetate solution

Molecular Formula: C12H10O2Molecular Weight: 186.206600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VGKONPUVOVVNSU-UHFFFAOYSA-N

• 1-Tert-Butyl-2-Imidazolidinone
IUPAC Name: 1-tert-butylimidazolidin-2-one | CAS Registry Number: 92075-16-6
Synonyms: 1-(tert-butyl)imidazolidin-2-one, 1-tert-butylimidazolidin-2-one, 1-tert-Butyl-2-imidazolidinone, ST50823809, ZINC00164021, AC1MDSWF, SureCN507511, CTK3J6303, 1-(tert-Butyl)-2-oxoimidazolidine, AKOS006223482, AG-H-77886, MCULE-6624729151, KB-13322, KB-147738, 1-(tert-Butyl)tetrahydro-2H-imidazol-2-one, FT-0608306, I14-113552

Molecular Formula: C7H14N2OMolecular Weight: 142.198860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VNXBETOLLOJKCA-UHFFFAOYSA-N

• 1-phenyl-3-methyl-1-pentyn-3-ol
IUPAC Name: 3-methyl-1-phenylpent-1-yn-3-ol | CAS Registry Number: 1966-65-0
Synonyms: 3-Methyl-1-phenyl-1-pentyn-3-ol, EINECS 217-814-9, 1-Pentyn-3-ol, 3-methyl-1-phenyl-, 1-Phenyl-3-methyl-1-pentyn-3-ol, 3-Methyl-1-phenylpent-1-yn-3-ol, CID102729, SBB008968

Molecular Formula: C12H14OMolecular Weight: 174.238960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MTBIBEIZKLZPIM-UHFFFAOYSA-N

• 1,4-Thioxane-1,1-Dioxide
IUPAC Name: 1,4-oxathiane 4,4-dioxide | CAS Registry Number: 107-61-9
Synonyms: Thioxane sulfone, p-Thioxane sulfone, Oxathiane 4,4-dioxide, USAF DO-38, WLN: T6O DSWTJ, 1,4-OXATHIANE, 4,4-DIOXIDE, EINECS 203-507-7, CID7878, NSC 39595, DFP00033, NSC39595, BRN 0110609, ZINC01671456, LS-99661, 4-19-00-00034 (Beilstein Handbook Reference), InChI=1/C4H8O3S/c5-8(6)3-1-7-2-4-8/h1-4H

Molecular Formula: C4H8O3SMolecular Weight: 136.169520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WWRUZECKUVNAPB-UHFFFAOYSA-N

• 1-Phenyl-2,2,2-Trifluoroethanol
IUPAC Name: 2,2,2-trifluoro-1-phenylethanol | CAS Registry Number: 340-05-6
Synonyms: 2,2,2-Trifluorophenylethanol, 79234_ALDRICH, 2,2,2-Trifluoro-1-phenylethanol, 319864_ALDRICH, 79234_FLUKA, alpha-(Trifluoromethyl)benzyl alcohol, CHEBI:273303, 1-Phenyl-2,2,2-trifluoroethanol, alpha-(Trifluoromethyl) benzyl alcohol, CID95556, NSC20214, 2,2,2-Trifluoro-1-phenyl-ethanol, EINECS 206-429-1, EINECS 206-430-7, EINECS 234-094-1, NSC 20214, alpha-(Trifluoromethyl)benzenemethanol, ()-1-Phenyl-2,2,2-trifluoroethanol, ()-alpha-(Trifluoromethyl)benzyl alcohol, Benzyl alcohol, alpha-(trifluoromethyl)-

Molecular Formula: C8H7F3OMolecular Weight: 176.135790 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VNOMEAQPOMDWSR-UHFFFAOYSA-N

• (3,3-Dimethylallyl)Triphenylphosphonium Bromide
IUPAC Name: 3-methylbut-2-enyl(triphenyl)phosphanium bromide | CAS Registry Number: 1530-34-3
Synonyms: EINECS 216-224-9, NSC219242, CID3083722, (3-Methylbut-2-enyl)triphenylphosphonium bromide

Molecular Formula: C23H24BrPMolecular Weight: 411.314421 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FTMCNCGWNJMMQS-UHFFFAOYSA-M

• 1-Amino-2-naphthol Hydrochloride
IUPAC Name: 1-aminonaphthalen-2-ol | CAS Registry Number: 1198-27-2
Synonyms: 1-Amino-2-naphthol, 2-Naphthalenol, 1-amino-, 2-Naphthol, 1-amino-, alpha-Amino-beta-naphthol, 1-Amino-2-hydroxynaphthalene, 2-Hydroxy-1-aminonaphthalene, .alpha.-Amino-.beta.-naphthol, ZERO/005859, NSC7938, NSC 7938, EINECS 220-606-0, ZINC00119429, EC-000.1432, LS-194583, 2834-92-6, 95609-86-2

Molecular Formula: C10H9NOMolecular Weight: 159.184560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FHMMQQXRSYSWCM-UHFFFAOYSA-N

• 1,7-Dioxaspiro[5.5]Undecane
IUPAC Name: 1,7-dioxaspiro[5.5]undecane | CAS Registry Number: 180-84-7
Synonyms: Olive-fly ketal, Olean, Eco-Trap, 1,7-Dioxaspiro[5.5]undecane, D7151_ALDRICH, D7151_SIGMA, 1,7-Dioxaspiro(5.5)undecane, CID67437, EINECS 205-870-7, ZINC00402864, NCGC00164386-01, InChI=1/C9H16O2/c1-3-7-10-9(5-1)6-2-4-8-11-9/h1-8H, 95273-63-5

Molecular Formula: C9H16O2Molecular Weight: 156.222140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GBBVHDGKDQAEOT-UHFFFAOYSA-N

• 1,3-Indandione
IUPAC Name: indene-1,3-dione | CAS Registry Number: 606-23-5
Synonyms: 1,3-INDANDIONE, 1,3-Indandion, 1,3-Diketohydrindene, Indan-1,3-dione, 1,3-Indanone, 1H-Indene-1,3(2H)-dione, 1,3-Dioxoindan, INDANEDIONE-1,3, I2002_ALDRICH, 45790_RIEDEL, NSC 6312, EINECS 210-109-7, NSC6312, NSC 26329, AIDS017987, AIDS-017987, NSC26329, BRN 1210061, STK202114, LS-81118

Molecular Formula: C9H6O2Molecular Weight: 146.142740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UHKAJLSKXBADFT-UHFFFAOYSA-N

• 1-Iodo-2,3-Dimethylbenzene
IUPAC Name: 1-iodo-2,3-dimethylbenzene | CAS Registry Number: 31599-60-7
Synonyms: 1-Iodo-2,3-dimethylbenzene, Benzene, 1-iodo-2,3-dimethyl-, CID141645, BBV-2090770, InChI=1/C8H9I/c1-6-4-3-5-8(9)7(6)2/h3-5H,1-2H

Molecular Formula: C8H9IMolecular Weight: 232.061530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DANMWBNOPFBJSZ-UHFFFAOYSA-N

• (S)-(+)-3,4,8,8a-Tetrahydro-8a-Methyl-1,6(2h,7h)-Naphthalenedione
IUPAC Name: 8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione | CAS Registry Number: 33878-99-8
Synonyms: Wieland-Michler ketone, Miescher-Wieland ketone, Wieland-Miescher ketone, M65157_ALDRICH, NSC87581, CID89262, EINECS 243-463-6, LT00233231, 9-(S)-Methyl-.delta.-5(10)-octalin-1,6-dione, 9(S)-Methyl-delta-5(10)-octalin-1,6-dione, (+/-)-9-Methyl-5(10)-octaline-1,6-dione, 8a-Methyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione, 8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-quinone, 3,4,8,8a-Tetrahydro-8a-methyl-(2H,7H)naphthalene-1,6-dione, 1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-methyl-, (+/-)-8a-Methyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione, 20007-72-1

Molecular Formula: C11H14O2Molecular Weight: 178.227660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DNHDRUMZDHWHKG-UHFFFAOYSA-N

• 1-Chloro-5-Iodopentane
IUPAC Name: 1-chloro-5-iodopentane | CAS Registry Number: 60274-60-4
Synonyms: 1-Chloro-5-iodopentane, Pentamethylene chloroiodide, Pentane, 1-chloro-5-iodo-, 521590_ALDRICH, EINECS 262-137-4, CID108914, OR2936

Molecular Formula: C5H10ClIMolecular Weight: 232.490370 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GUUHKOCYWBEGGX-UHFFFAOYSA-N

• 1,2,4-Benzenetriol
IUPAC Name: benzene-1,2,4-triol | CAS Registry Number: 533-73-3
Synonyms: Hydroxyquinol, Hydroxyhydroquinone, 1,2,4-BENZENETRIOL, Oxyhydroquinone, 1,2,4-Trihydroxybenzene, Benzene-1,2,4-triol, 4-Hydroxycatechol, 2,5-Dihydroxyphenol, Hydroquinone, hydroxy-, Ambap71, 1,3,4-Benzenetriol, 1,3,4-Trihydroxybenzene, Oxyhydrochinon [German], WLN: QR BQ DQ, CCRIS 2987, 173401_ALDRICH, NSC 2818, CHEBI:16971, EINECS 208-575-1, NSC2818

Molecular Formula: C6H6O3Molecular Weight: 126.110040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: GGNQRNBDZQJCCN-UHFFFAOYSA-N

• 4-Iodo-1,2-Dimethylbenzene
IUPAC Name: 4-iodo-1,2-dimethylbenzene | CAS Registry Number: 31599-61-8
Synonyms: 4-Iodo-o-xylene, 1,2-Dimethyl-4-iodobenzene, Benzene, 4-iodo-1,2-dimethyl-, 1-Iodo-3,4-dimethylbenzene, 392499_ALDRICH, CID141646, BBV-2090789, InChI=1/C8H9I/c1-6-3-4-8(9)5-7(6)2/h3-5H,1-2H

Molecular Formula: C8H9IMolecular Weight: 232.061530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CSFRCLYFVINMBZ-UHFFFAOYSA-N

• 1-(boc-amino)cyclopentanecarboxylic Acid
IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylate | CAS Registry Number: 35264-09-6
Synonyms: ZINC04202565, CID7128354

Molecular Formula: C11H18NO4-Molecular Weight: 228.264920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YBZCSKVLXBOFSL-UHFFFAOYSA-M

• 1-Chloro-5-Phenylpentane
IUPAC Name: 5-chloropentylbenzene | CAS Registry Number: 15733-63-8
Synonyms: 5-Phenyl-1-pentyl chloride, (5-Chloropentyl)benzene, 1-Chloro-5-phenylpentane, AG-E-06333, ST50827682, 5-chloropentylbenzene, ACMC-20aovs, AC1LART2, Benzene,(5-chloropentyl)-, SureCN1006673, 5-PHENYLPENTYLCHLORIDE, Benzene, (5-chloropentyl)-, 5-PHENYLPENTYL CHLORIDE, CTK4C9347, ZINC02384754, AKOS009158398, MCULE-4049620045, AK135585, KB-11947, FT-0607636

Molecular Formula: C11H15ClMolecular Weight: 182.689800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UXJLBVYYDZDPBV-UHFFFAOYSA-N

• 1-Pentadecanol
IUPAC Name: pentadecan-1-ol | CAS Registry Number: 629-76-5
Synonyms: n-Pentadecanol, 1-PENTADECANOL, Pentadecyl alcohol, Pentadecanol, pentadecan-1-ol, n-pPentadecanol, n-1-Pentadecanol, Alcohols, C12-18, Alcohols, C14-16, (C12-C18)-Alkyl alcohol, 412228_ALDRICH, 76520_FLUKA, CHEBI:133152, CID12397, NSC66446, EINECS 211-107-9, EINECS 267-006-5, CPD-11595, LMFA05000194, NSC 66446

Molecular Formula: C15H32OMolecular Weight: 228.413980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: REIUXOLGHVXAEO-UHFFFAOYSA-N

• 1-(4-Methoxyphenyl)Ethanol
IUPAC Name: 1-(4-methoxyphenyl)ethanol | CAS Registry Number: 3319-15-1
Synonyms: 1-(4-Methoxyphenyl)ethanol, 4-Methoxyphenyl methyl carbinol, 154113_ALDRICH, 4-Methoxy-alpha-methylbenzyl alcohol, AKE-BBV-142551, NSC406712, 4-Methoxy-.alpha.-methylbenzyl alcohol, EINECS 222-019-5, CID101148, BBV-142551, Benzenemethanol, 4-methoxy-alpha-methyl-, AI3-05520

Molecular Formula: C9H12O2Molecular Weight: 152.190380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IUUULXXWNYKJSL-UHFFFAOYSA-N

• 1,2-Dibromo tetrachloroethane
IUPAC Name: 1,2-dibromo-1,1,2,2-tetrachloroethane | CAS Registry Number: 630-25-1
Synonyms: Dbtce, sym-Dibromotetrachloroethane, 1,2-Dibromotetrachloroethane, Ambap1430, 133396_ALDRICH, 34380_FLUKA, EINECS 211-136-7, 1,2-Dibromo-1,1,2,2-tetrachloroethane, CID69426, Ethane, 1,2-dibromo-1,1,2,2-tetrachloro-, BRN 1699471, AI3-63171, LS-65484, TL8004365, 3-01-00-00190 (Beilstein Handbook Reference)

Molecular Formula: C2Br2Cl4Molecular Weight: 325.641400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WJUKOGPNGRUXMG-UHFFFAOYSA-N

• 1-Dodecanoylpyrrolidine
IUPAC Name: 1-pyrrolidin-1-yldodecan-1-one | CAS Registry Number: 70974-45-7
Synonyms: NSC60381, CID246839

Molecular Formula: C16H31NOMolecular Weight: 253.423440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UGVISXRNXOQBBY-UHFFFAOYSA-N

• 1-(3-Chlorophenyl)ethanol
IUPAC Name: 1-(3-chlorophenyl)ethanol | CAS Registry Number: 6939-95-3
Synonyms: 1-(3-chlorophenyl)ethanol, 3-Chloro-alpha-methylbenzyl alcohol, NSC38772, EINECS 230-079-9

Molecular Formula: C8H9ClOMolecular Weight: 156.609460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QYUQVBHGBPRDKN-UHFFFAOYSA-N

• 1-Ethyl-3-Methylimidazolium Trifluoromethanesulfonate
IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;trifluoromethanesulfonate | CAS Registry Number: 145022-44-2
Synonyms: 1-Ethyl-3-methylimidazolium trifluoromethanesulfonate, EMIM Otf, ACMC-209ctv, AC1MBZ4M, DSSTox_CID_27941, DSSTox_RID_82693, DSSTox_GSID_47965, KSC685I3D, 68101_ALDRICH, 00738_FLUKA, 04367_FLUKA, 68101_FLUKA, CTK5I5431, MolPort-003-925-017, Tox21_201039, 1-Ethyl-3-methylimidazolium Triflate, ANW-20897, AKOS015853004, AKOS015903871, AG-A-19883

Molecular Formula: C7H11F3N2O3SMolecular Weight: 260.234050 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: ZPTRYWVRCNOTAS-UHFFFAOYSA-M

• 1-Methylbenzotriazole
IUPAC Name: 1-methylbenzotriazole | CAS Registry Number: 13351-73-0
Synonyms: Tolutriazole, Tolyltriazole, Tolyl triazole, Tolytriazole, Cobratec TT 100, 1H-Benzotriazole, 1-methyl-, Methyl-1H-benzotriazole, 1-Methyl-1,2,3-benzotriazole, 1-METHYLBENZOTRIAZOLE, 1-Methyl-1H-benzotriazole, Olin 53734, CCRIS 4738, 1H-Benzotriazole, 1-methyl, 1H-BENZOTRIAZOLE, METHYL-, WLN: T56 BNNNJ B1, 1H-Benzotriazole, 4(5)-methyl-, EINECS 236-401-4, EINECS 249-596-6, NSC 11743, 1H-Benzotriazole, 4(or 5)-methyl-

Molecular Formula: C7H7N3Molecular Weight: 133.150580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HXQHRUJXQJEGER-UHFFFAOYSA-N

• 1h,1h-Perfluoro-1-Tetradecanol
IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecan-1-ol | CAS Registry Number: 15622-57-8
Synonyms: 1H,1H-Perfluoro-1-tetradecanol, 1h,1h-perfluorotetradecan-1-ol, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecan-1-ol, AC1MCQX7, CTK8F1112, PC6218J, MolPort-000-158-129, AKOS015912382, AG-E-04989, FT-0607854, A809724, I14-36328, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluoro-1-tetradecanol, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosakis(fluoranyl)tetradecan-1-ol

Molecular Formula: C14H3F27OMolecular Weight: 700.129906 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 28

InChIKey: WYCXYEWKMLSDBQ-UHFFFAOYSA-N

• 2,3,3-Trimethyl-3H-indole
IUPAC Name: 2,3,3-trimethylindole | CAS Registry Number: 1640-39-7
Synonyms: 2,3,3-Trimethylindolenine, 2,3,3-TRIMETHYL-3H-INDOLE, 3H-Indole, 2,3,3-trimethyl-, CCRIS 6607, T76805_ALDRICH, EINECS 216-685-6, NSC 65633, BB_SC-4660, NSC65633, ZINC03860805, AI3-51456, LS-188246, TL80074169, T-6650

Molecular Formula: C11H13NMolecular Weight: 159.227620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FLHJIAFUWHPJRT-UHFFFAOYSA-N

• 1-Methoxy-2-Indanol
IUPAC Name: (1S,2R)-1-methoxy-2,3-dihydro-1H-inden-2-ol | CAS Registry Number: 56175-44-1
Synonyms: STOCK1N-09750, ZINC00406960, CID6951527

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

InChIKey: ZHWPZRVYPHGXSF-ZJUUUORDSA-N

• (R)(-)-1-Phenyl-1,2-Ethanediol
IUPAC Name: (1S)-1-phenylethane-1,2-diol | CAS Registry Number: 16355-00-3
Synonyms: ()-Styrene glycol, 1-phenylethane-1,2-diol, 1-Phenyl-1,2-ethanediol, 1,2-Ethanediol, 1-phenyl-, (S)-()-Phenylethylene glycol, 302155_ALDRICH, TE5119, ZINC00391852, (S)-()-1-Phenyl-1,2-ethanediol, 93-56-1, InChI=1/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H

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

InChIKey: PWMWNFMRSKOCEY-MRVPVSSYSA-N

• 1-N-Butyl-4-(Ethylthio)Benzene
IUPAC Name: 1-butyl-4-ethylsulfanylbenzene | CAS Registry Number: 216393-65-6
Synonyms: 1-n-Butyl-4-(ethylthio)benzene, ST50408380, ZINC02244207, 4-butyl-1-ethylthiobenzene, CTK8E3284, MCULE-1267538233, KB-160160, FT-0608144, I14-56595

Molecular Formula: C12H18SMolecular Weight: 194.336320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KJPCRLLXIOTRAN-UHFFFAOYSA-N

• 1-Bromo-4-iodobenzene
IUPAC Name: 1-bromo-4-iodobenzene | CAS Registry Number: 589-87-7
Synonyms: p-Bromoiodobenzene, p-Iodobromobenzene, p-Bromophenyl iodide, Benzene, 1-bromo-4-iodo-, 4-BROMOIODOBENZENE, 238090_ALDRICH, NSC8033, NSC 8033, EINECS 209-662-7, BBV-080402, AI3-09032, InChI=1/C6H4BrI/c7-5-1-3-6(8)4-2-5/h1-4

Molecular Formula: C6H4BrIMolecular Weight: 282.904430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UCCUXODGPMAHRL-UHFFFAOYSA-N

• 1-N-Propylisoquinolinium Bromide
IUPAC Name: 2-propylisoquinolin-2-ium;bromide | CAS Registry Number: 86377-01-7
Synonyms: 2-Propylisoquinolinium bromide, Isoquinolinium, 2-propyl-, bromide, 1-N-PROPYLISOQUINOLINIUM BROMIDE, ST51038312, SureCN6024510, 2-propylisoquinoline, bromide, AGN-PC-00K96Z, 412872_ALDRICH, CTK3C7335, AKOS015897207, AG-H-48297, FT-0608169, I08-1139

Molecular Formula: C12H14BrNMolecular Weight: 252.150260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HXBKQAMIOUZDIX-UHFFFAOYSA-M

• 2,3-dichlorobromobenzene
IUPAC Name: 1-bromo-2,3-dichlorobenzene | CAS Registry Number: 56961-77-4
Synonyms: 1-BROMO-2,3-DICHLOROBENZENE, 280089_ALDRICH, Benzene, 1-bromo-2,3-dichloro-, EINECS 260-476-2, CID42066, FS000808, ST5405338, InChI=1/C6H3BrCl2/c7-4-2-1-3-5(8)6(4)9/h1-3

Molecular Formula: C6H3BrCl2Molecular Weight: 225.898020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: HVKCZUVMQPUWSX-UHFFFAOYSA-N

• 1-N-Propylpiperazine Dihydrobromide
IUPAC Name: 1-propylpiperazine dihydrobromide | CAS Registry Number: 64262-23-3
Synonyms: N-Propylpiperazinium dibromide, 141674_ALDRICH, EINECS 264-759-1, CID3085288, LT03378926

Molecular Formula: C7H18Br2N2Molecular Weight: 290.039220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YTPQLWVHCBATKO-UHFFFAOYSA-N

• 1-Phenyl-3-(Trifluoromethyl)-2-Pyrazolin-5-One
IUPAC Name: 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one | CAS Registry Number: 321-07-3
Synonyms: Maybridge4_000200, ARONIS023059, CHEBI:469242, CID668302, STK042259, ZINC00028402, IDI1_030782, EC-000.1827, 1-Phenyl-3-trifluoromethyl-2-pyrazolin-5-one, 1-phenyl-3-trifluoromethyl-1H-pyrazol-5(4H)-one, 1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5(4H)-one, 2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one, T0511-4778

Molecular Formula: C10H7F3N2OMolecular Weight: 228.170590 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: GLGRRRKQSFURGD-UHFFFAOYSA-N

• 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-1-Octanol
IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-1-ol | CAS Registry Number: 647-42-7
Synonyms: 1122-FTOH cpd, 370533_ALDRICH, 1H,1H,2H,2H-Perfluorooctanol, 77278_FLUKA, 1H,1H,2H,2H-Perfluorooctan-1-ol, CID69537, EINECS 211-477-1, 1H,1H,2H,2H-Perfluoro-1-octanol, 1,1,2,2-Tetrahydroperfluoro-1-octanol, C508406, 1-Octanol, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-1-octanol, 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctan-1-ol, 119937-79-0

Molecular Formula: C8H5F13OMolecular Weight: 364.103942 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 14

InChIKey: GRJRKPMIRMSBNK-UHFFFAOYSA-N


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