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Profile: Trans World Chemicals, Inc. specializes in the manufacturing of chemical intermediates. Our products include isothiocyanates, thioureas, amines, benzyl halides, carboxylic acids, nitriles and heterocycles.

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• 1-(2,5-Dimethoxyphenyl)-2-thiourea
IUPAC Name: (2,5-dimethoxyphenyl)thiourea | CAS Registry Number: 67617-98-5
Synonyms: (2,5-dimethoxyphenyl)thiourea, 2,5-dimethoxyphenylthiourea, 1-(2,5-dimethoxyphenyl)thiourea, SBB056746, amino[(2,5-dimethoxyphenyl)amino]methane-1-thione, ZINC00154613, AC1MBY9I, AC1Q48U2, CTK8F3851, n-(2,5-dimethoxyphenyl)thiourea, MolPort-000-154-700, STK374494, AKOS005447498, AG-L-63253, MCULE-8364503555, KB-63805, FT-0610410, FT-0610411, ST50825620, EN300-66535

Molecular Formula: C9H12N2O2SMolecular Weight: 212.268780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZLGQKHQZDDTIFW-UHFFFAOYSA-N

• 4-Chlorostyrene
IUPAC Name: 1-chloro-4-ethenylbenzene | CAS Registry Number: 1073-67-2
Synonyms: Parachlorostyrene, Styrene, p-chloro-, P-CHLOROSTYRENE, Styrene, 4-chloro-, Benzene, 1-chloro-4-ethenyl-, Poly(4-chlorostyrene), Ambap1426, 1-Chloro-4-vinylbenzene, C71203_ALDRICH, Styrene, p-chloro- (8CI), HSDB 3451, 434124_ALDRICH, EINECS 214-028-8, NSC 18603, NSC18603, LS-29481, InChI=1/C8H7Cl/c1-2-7-3-5-8(9)6-4-7/h2-6H,1H

Molecular Formula: C8H7ClMolecular Weight: 138.594180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KTZVZZJJVJQZHV-UHFFFAOYSA-N

• 2-Amino-N-methylbenzamide
IUPAC Name: 2-amino-N-methylbenzamide | CAS Registry Number: 4141-08-6
Synonyms: o-Amino-N-methylbenzamide, Benzamide, o-amino-N-methyl-, Oprea1_113871, ARONIS011055, ALD-N012072, CID308072, NSC207861, ZINC00294877, SDCCGMLS-0064579.P001, LS-25571, CV2311670, AQ-360/40271990

Molecular Formula: C8H10N2OMolecular Weight: 150.177800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KIMWOULVHFLJIU-UHFFFAOYSA-N

• 1-(3-Fluorophenyl)Imidazole
IUPAC Name: 1-(3-fluorophenyl)imidazole | CAS Registry Number: 25372-42-3
Synonyms: 1-(3-fluorophenyl)imidazole, ZINC02528149, PubChem6499, (3-fluorophenyl)imidazole, SureCN870900, AC1MC7D3, CHEMBL1650270, CTK4F5585, MolPort-001-775-437, 1-(3-fluorophenyl)-1H-imidazole, 1H-Imidazole,1-(3-fluorophenyl)-, SBB087601, AKOS006229581, AG-E-77600, KB-84181, FT-0605629, ST51055115, C-5513, A817831, Imidazole,1-(m-fluorophenyl)- (8CI);1-(3-Fluorophenyl)-1H-imidazole;

Molecular Formula: C9H7FN2Molecular Weight: 162.163683 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SQJDRLQZCRNMQU-UHFFFAOYSA-N

• 3,4-Dihydroxybenzhydrazide
IUPAC Name: 3,4-dihydroxybenzohydrazide | CAS Registry Number: 39635-11-5
Synonyms: Ambap3371, 3,4-Dihydroxybenzohydrazide, ZINC00156565, EINECS 254-550-3, CID586300, Benzoic acid, 3,4-dihydroxy-, hydrazide, 7732-32-3

Molecular Formula: C7H8N2O3Molecular Weight: 168.150020 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: WGXWEXNJRZMIPT-UHFFFAOYSA-N

• 3-Benzyloxyphenyl isothiocyanate
IUPAC Name: 1-isothiocyanato-3-phenylmethoxybenzene | CAS Registry Number: 206559-36-6
Synonyms: 1-(Benzyloxy)-3-isothiocyanatobenzene, 1-isothiocyanato-3-phenylmethoxybenzene, ST50825892, ZINC02528089, AC1LBODF, ACMC-20an9f, CTK4E4798, MolPort-001-761-297, 3-(phenylmethoxy)benzenisothiocyanate, AKOS005207275, AG-E-51542, MCULE-4552322402, 1-isothiocyanato-3-phenylmethoxy-benzene, BP-11168, KB-83616, FT-0615106, M-1710, A814772, I09-2441

Molecular Formula: C14H11NOSMolecular Weight: 241.308240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QJLFNDXMZQJMDL-UHFFFAOYSA-N

• 4-Benzyloxy-3-methoxyphenylacetonitrile
IUPAC Name: 2-[3-methoxy-4-(phenylmethoxy)phenyl]acetonitrile | CAS Registry Number: 1700-29-4
Synonyms: NSC169520, CID297963, ZINC00391541, ST5408440

Molecular Formula: C16H15NO2Molecular Weight: 253.295800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KSOYPRFHKIOHMY-UHFFFAOYSA-N

• 3-Bromo-4-iodotoluene
IUPAC Name: 2-bromo-1-iodo-4-methylbenzene | CAS Registry Number: 71838-16-9
Synonyms: 2-Bromo-1-iodo-4-methylbenzene, 1-bromo-2-iodo-5-methylbenzene, 2-Bromo-4-methyliodobenzene, PubChem3792, AC1LCEMQ, ACMC-209okc, SureCN2722113, CTK5D5139, MolPort-000-152-143, 2-Bromo-1-iodo-4-methylbenzene,, Benzene,2-bromo-1-iodo-4-methyl-, ANW-36106, ZINC02568094, Benzene, 2-bromo-1-iodo-4-methyl-, AKOS015834647, 2-bromanyl-1-iodanyl-4-methyl-benzene, AG-G-81984, AS03375, AK117493, KB-21097

Molecular Formula: C7H6BrIMolecular Weight: 296.931010 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PLAKKSAFIZVHJP-UHFFFAOYSA-N

• 3,5-Dihydroxybenzhydrazide
IUPAC Name: 3,5-dihydroxybenzohydrazide | CAS Registry Number: 7732-32-3
Synonyms: 3,5-Dihydroxybenzohydrazide, Oprea1_197382, ALBB-002501, ZINC00405095, ST5411446

Molecular Formula: C7H8N2O3Molecular Weight: 168.150020 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: FJBLNCPJAVARBR-UHFFFAOYSA-N

• 5-Bromo-2-methoxyphenethylamine hydrobromide
IUPAC Name: 2-(5-bromo-2-methoxyphenyl)ethanamine;hydrobromide | CAS Registry Number: 206559-44-6
Synonyms: 2-(5-bromo-2-methoxyphenyl)ethanamine hydrobromide, 5-bromo-2-methoxyphenethylaminehydrobromide, AC1MBUXW, SureCN778334, 560189_ALDRICH, CTK7A6041, MolPort-000-152-168, ACT03959, AKOS015833520, AG-A-31740, AK116561, KB-83622, KB-208605, A4486, FT-0082120, LT03497698, (5-bromo-2-methoxybenzyl)methylamine hydrobromide, 2-(5-bromo-2-methoxyphenyl)ethylamine hydrobromide, benzeneethanamine, 5-bromo-2-methoxy-, hydrobromide, I01-7177

Molecular Formula: C9H13Br2NOMolecular Weight: 311.013620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NWMRUSBUYMGDSC-UHFFFAOYSA-N

• 3-(3-Bromophenyl)propionic acid
IUPAC Name: 3-(3-bromophenyl)propanoic acid | CAS Registry Number: 42287-90-1
Synonyms: 3-(3-bromophenyl)propanoic Acid, 3-(3-Bromo-phenyl)-propionic acid, SBB063235, AG-F-50362, ACMC-209jor, SureCN6586, 3-Bromobenzenepropanoic acid, AGN-PC-00H2UL, Benzenepropanoic acid,3-bromo-, 681148_ALDRICH, AC1M158L, AC1Q758T, CTK4I5985, DWKWMFSWLCIMKI-UHFFFAOYSA-, MolPort-000-152-356, 3-BROMOPHENYLPROPANOIC ACID, ACN-S004297, ANW-29785, AKOS002528296, AB08444

Molecular Formula: C9H9BrO2Molecular Weight: 229.070560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DWKWMFSWLCIMKI-UHFFFAOYSA-N

• 3,5-Bis(trifluoromethyl)benzamide
IUPAC Name: 3,5-bis(trifluoromethyl)benzamide | CAS Registry Number: 22227-26-5
Synonyms: 3,5-di(Trifluoromethyl)benzamide, 559997_ALDRICH, ZINC00152628, JRD-0399, EINECS 244-849-7, CID519927, 3S211027

Molecular Formula: C9H5F6NOMolecular Weight: 257.132519 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: YNOPIKHMZIOWHS-UHFFFAOYSA-N

• 4-tert-Butylbenzylamine
IUPAC Name: (4-tert-butylphenyl)methanamine | CAS Registry Number: 39895-55-1
Synonyms: 4-tert-Butyl-benzylamine, 631280_ALDRICH, EINECS 254-681-6, ASN 16289515, CID2735655, ST5401635

Molecular Formula: C11H17NMolecular Weight: 163.259380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MPWSRGAWRAYBJK-UHFFFAOYSA-N

• 2,6-Dimethyl Benzoic Acid
IUPAC Name: 2,6-dimethylbenzoic acid | CAS Registry Number: 632-46-2
Synonyms: 2,6-DIMETHYLBENZOIC ACID, Benzoic acid, 2,6-dimethyl-, vic.-m-Xylylic acid, 156906_ALDRICH, 39585_FLUKA, EINECS 211-177-0, BRN 1863791, SBB007881, FR-0509, LS-37159, TL8004400, 4-09-00-01798 (Beilstein Handbook Reference), AL-398/25017066, InChI=1/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HCBHQDKBSKYGCK-UHFFFAOYSA-N

• 2-(4-Biphenyl)ethylamine
IUPAC Name: 2-(4-phenylphenyl)ethanamine | CAS Registry Number: 17027-51-9
Synonyms: 2-(4-phenylphenyl)ethanamine, 4-Phenylphenethylamine, 2-biphenyl-4-yl-ethylamine, 2-(4-Phenylphenyl)Ethan-1-Amine, SBB028406, 2-(4-phenylphenyl)ethylamine, 2-biphenylethylamine, AC1L1EUM, 17027-69-9, 4-(2-aminoethyl)biphenyl, SureCN172790, AC1Q54AO, 2-(4-Biphenylyl)ethanamine;, 560227_ALDRICH, [1,1'-Biphenyl]-4-ethanamine, CTK0H3707, MolPort-000-151-482, AKOS000156890, AG-C-53046, MCULE-4311723082

Molecular Formula: C14H15NMolecular Weight: 197.275600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WHPLBPSDTIZFSX-UHFFFAOYSA-N

• 2-Bromothiophene
IUPAC Name: 2-bromothiophene | CAS Registry Number: 1003-09-4
Synonyms: 2-BROMOTHIOPHENE, Thiophene, 2-bromo-, 2-Thienyl bromide, sFpDAbHHRYSZZP@, 124168_ALDRICH, NSC4456, NSC 4456, EINECS 213-699-4, SBB003931, ZINC01673392, TL8000043, H23029, InChI=1/C4H3BrS/c5-4-2-1-3-6-4/h1-3

Molecular Formula: C4H3BrSMolecular Weight: 163.035620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: TUCRZHGAIRVWTI-UHFFFAOYSA-N

• 9-Fluorenone-2,7-dicarboxylic acid
IUPAC Name: 9-oxofluorene-2,7-dicarboxylic acid | CAS Registry Number: 792-26-7
Synonyms: 9-oxofluorene-2,7-dicarboxylic Acid, 9-Oxo-9H-fluorene-2,7-dicarboxylic acid, SBB069088, zlchem 672, AC1MBZAG, SureCN600296, 2,7-dicarboxy-9-fluorenone, CTK2H6917, fluorenone-2,7-dicarboxylic acid, ZLD0124, MolPort-000-155-427, ACT05905, ANW-55004, AKOS001582633, AG-H-17957, CCG-138415, MCULE-8021002789, AK-78724, 9-Fluorenone-2,7-dicarboxylic acid, tech., 9H-Fluorene-2,7-dicarboxylicacid, 9-oxo-

Molecular Formula: C15H8O5Molecular Weight: 268.221020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: XMIFYVJZYNTBTI-UHFFFAOYSA-N

• 2-Fluorodiphenylmethane
IUPAC Name: 1-fluoro-2-(phenylmethyl)benzene | CAS Registry Number: 3794-15-8
Synonyms: 1-Benzyl-2-fluorobenzene, NCIOpen2_001931, NSC99453

Molecular Formula: C13H11FMolecular Weight: 186.224843 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YWWVDXKZLGXVHT-UHFFFAOYSA-N

• 5-Bromoisatoic anhydride
IUPAC Name: 6-bromo-1H-3,1-benzoxazine-2,4-dione | CAS Registry Number: 4692-98-2
Synonyms: 441066_ALDRICH, 477702_ALDRICH, ALBB-008790, NSC149816, ZINC00396116, 6-bromo-2H-3,1-benzoxazine-2,4(1H)-dione, ST5165822, 2H-3,1-benzoxazine-2,4(1H)-dione, 6-bromo-, 6-Bromo-1,2-dihydro-4H-3,1-benzoxazine-2,4-dione, InChI=1/C8H4BrNO3/c9-4-1-2-6-5(3-4)7(11)13-8(12)10-6/h1-3H,(H,10,12

Molecular Formula: C8H4BrNO3Molecular Weight: 242.026260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DXSMYDSFWCOSFM-UHFFFAOYSA-N

• 1-(4-Chlorophenyl)Imidazole
IUPAC Name: 1-(4-chlorophenyl)imidazole | CAS Registry Number: 51581-54-5
Synonyms: 1-(4-Chlorophenyl)imidazole, 1-CPI, 1-(4-Chlorophenyl)-1H-imidazole, ZINC00156200, CID142859, LT00454089, 1CI

Molecular Formula: C9H7ClN2Molecular Weight: 178.618280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BARLRKAYTDVUIS-UHFFFAOYSA-N

• 4-Fluoro-3-iodotoluene
IUPAC Name: 1-fluoro-2-iodo-4-methylbenzene | CAS Registry Number: 452-82-4
Synonyms: 646334_ALDRICH, NSC29032, CID232023, TL8003149

Molecular Formula: C7H6FIMolecular Weight: 236.025413 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XJWZEEGCMBQBNG-UHFFFAOYSA-N

• 4-Bromodiphenylmethane
IUPAC Name: 1-bromo-4-(phenylmethyl)benzene | CAS Registry Number: 2116-36-1
Synonyms: 1-benzyl-4-bromobenzene, Methane, (p-bromophenyl)phenyl-, NSC38004, Benzene, 1-bromo-4-(phenylmethyl)-, InChI=1/C13H11Br/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H

Molecular Formula: C13H11BrMolecular Weight: 247.130440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NNEOYCMCJMLRSD-UHFFFAOYSA-N

• 5-Bromo-2-iodobenzoic acid
IUPAC Name: 5-bromo-2-iodobenzoic acid | CAS Registry Number: 21740-00-1
Synonyms: NSC190696, CID302939

Molecular Formula: C7H4BrIO2Molecular Weight: 326.913930 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IGBNDUKRHPTOBP-UHFFFAOYSA-N

• 1-Benzyl-3-phenyl-2-thiourea
IUPAC Name: 1-phenyl-3-(phenylmethyl)thiourea | CAS Registry Number: 726-25-0
Synonyms: 1-Benzyl-3-phenylthiourea, Probes1_000002, Probes2_000403, N-Phenyl-N'-benzylthiourea, CBDivE_009624, Urea, 1-benzyl-3-phenyl-2-thio-, ARONIS023056, Thiourea, N-phenyl-N'-(phenylmethyl)-, NSC25017, ZINC03078995, ZINC04247027, ST040877

Molecular Formula: C14H14N2SMolecular Weight: 242.339360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: NXCBDDGSOXJEFZ-UHFFFAOYSA-N

• 3-(2,6-Dichlorophenyl)propanoic Acid
IUPAC Name: 3-(2,6-dichlorophenyl)propanoic acid | CAS Registry Number: 51656-68-9
Synonyms: 3-(2,6-dichlorophenyl)propanoic Acid, 3-(2,6-DICHLOROPHENYL)PROPIONIC ACID, AC1MBXLO, SureCN2109135, AC1Q757O, CTK4J4637, 2,6-Dichlorobenzenepropanoic acid, MolPort-000-154-127, Benzenepropanoic acid,2,6-dichloro-, SBB017794, STL302080, AKOS000169006, AG-F-75116, MCULE-5135125740, AK130354, KB-85841, 3-[2,6-bis(chloranyl)phenyl]propanoic acid, FT-0676231, C-5876, A828717

Molecular Formula: C9H8Cl2O2Molecular Weight: 219.064620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IDEOVPXKPDUXTP-UHFFFAOYSA-N

• 1-(2,5-Difluorophenyl)-2-thiourea
IUPAC Name: (2,5-difluorophenyl)thiourea | CAS Registry Number: 207981-44-0
Synonyms: (2,5-Difluorophenyl)thiourea, 1-(2,5-Difluorophenyl)thiourea, 2,5-DIFLUOROPHENYLTHIOUREA, AG-E-52688, ST50825287, amino[(2,5-difluorophenyl)amino]methane-1-thione, ZINC00156320, ACMC-209w9g, AC1MCO48, 654868_ALDRICH, AC1Q502L, N-(2,5-difluorophenyl)thiourea, CTK4E5138, MolPort-001-775-540, Thiourea,N-(2,5-difluorophenyl)-, ANW-46082, SBB090771, AKOS005207159, 1-[2,5-bis(fluoranyl)phenyl]thiourea, MCULE-1395052677

Molecular Formula: C7H6F2N2SMolecular Weight: 188.197746 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JBWSNSWRTOFDBM-UHFFFAOYSA-N

• 2-Chloro-4-nitroanisole
IUPAC Name: 2-chloro-1-methoxy-4-nitrobenzene | CAS Registry Number: 4920-79-0
Synonyms: Chloronitroanisole, OCNA, Orthochloroparanitroanisole, 2-Chloro-4-nitro-anisole, ANISOLE, 2-CHLORO-4-NITRO-, 2-Chloro-1-methoxy-4-nitrobenzene, EINECS 225-547-4, Benzene, 2-chloro-1-methoxy-4-nitro-, CID21027, NSC94734, BRN 2209429, ZINC00162396, LS-20208, Benzene, 2-chloro-1-methoxy-4-nitro- (9CI), 4-06-00-01354 (Beilstein Handbook Reference)

Molecular Formula: C7H6ClNO3Molecular Weight: 187.580440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DLJPNXLHWMRQIQ-UHFFFAOYSA-N

• 3-Chloro-2-Methylanisole
IUPAC Name: 1-chloro-3-methoxy-2-methylbenzene | CAS Registry Number: 3260-88-6
Synonyms: 3-Chloro-2-methylanisole, 523232_ALDRICH, ZINC00403412, CID76749, EINECS 221-862-6

Molecular Formula: C8H9ClOMolecular Weight: 156.609460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LTVRGAWOEOKGJZ-UHFFFAOYSA-N

• 1-Benzoyl-3-phenyl-2-thiourea
IUPAC Name: N-(phenylcarbamothioyl)benzamide | CAS Registry Number: 4921-82-8
Synonyms: Phenyl benzoyl thiourea, WLN: SUYMR&MVR, CBMicro_019876, USAF K-1473, Benzamide, N-phenylthiocarbamoyl-, N-Benzoyl-N'-phenylthiourea, NSC 5817, NSC5817, UREA, 1-BENZOYL-3-PHENYL-2-THIO-, AI3-24581, Benzamide, N-[(phenylamino)thioxomethyl]-, Benzamide, N-((phenylamino)thioxomethyl)-, BIM-0020150.P001, LS-158926, ST5035646, Benzamide, N-((phenylamino)thioxomethyl)- (9CI), SR-01000635902-1

Molecular Formula: C14H12N2OSMolecular Weight: 256.322880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: GVHZQIIMGRLFMX-UHFFFAOYSA-N

• 4-Ethoxy-3-methoxyphenylacetic acid
IUPAC Name: 2-(4-ethoxy-3-methoxyphenyl)acetic acid | CAS Registry Number: 120-13-8
Synonyms: NSC62696, CID67112, EINECS 204-372-7, Benzeneacetic acid, 4-ethoxy-3-methoxy-, Acetic acid, (4-ethoxy-3-methoxyphenyl)-, ST5409968

Molecular Formula: C11H14O4Molecular Weight: 210.226460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: XVNXRPVJRCYHEW-UHFFFAOYSA-N

• 3,5-Bis(trifluoromethyl)phenyl isothiocyanate
IUPAC Name: 1-isothiocyanato-3,5-bis(trifluoromethyl)benzene | CAS Registry Number: 23165-29-9
Synonyms: 468517_ALDRICH, ZINC00164749, CID2733395, SB 01673, TL80073708, 1-isothiocyanato-3,5-bis(trifluoromethyl)benzene, 3,5-BIS-TRIFLUOROMETHYLPHENYL ISOTHIOCYANATE

Molecular Formula: C9H3F6NSMolecular Weight: 271.182239 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: FXOSSGVJGGNASE-UHFFFAOYSA-N

• 4-Cyanobiphenyl
IUPAC Name: 4-phenylbenzonitrile | CAS Registry Number: 2920-38-9
Synonyms: p-Cyanobiphenyl, p-Phenylbenzonitrile, 4-CYANOBIPHENYL, 4-Phenylbenzonitrile, Biphenyl-4-carbonitrile, 4-Biphenylcarboxylic acid nitrile, 225029_ALDRICH, (1,1'-Biphenyl)-4-carbonitrile, [1,1'-Biphenyl]-4-carbonitrile, EINECS 220-860-2, NSC176013, STK028923, ZINC01720496, NSC 176013, TL8002299, InChI=1/C13H9N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9

Molecular Formula: C13H9NMolecular Weight: 179.217260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BPMBNLJJRKCCRT-UHFFFAOYSA-N

• 2-(3-Chlorophenyl)ethylamine
IUPAC Name: 2-(3-chlorophenyl)ethylazanium | CAS Registry Number: 13078-79-0
Synonyms: ZINC00389622, CID6950348

Molecular Formula: C8H11ClN+Molecular Weight: 156.632640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: NRHVNPYOTNGECT-UHFFFAOYSA-O

• 3,4-Dimethoxy-b-nitrostyrene
IUPAC Name: 1,2-dimethoxy-4-(2-nitroethenyl)benzene | CAS Registry Number: 4230-93-7
Synonyms: Oprea1_051858, CBDivE_000231, NSC7390, NSC31600, ZINC00099489

Molecular Formula: C10H11NO4Molecular Weight: 209.198640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SYJMYDMKPSZMSB-UHFFFAOYSA-N

• 4-Chloro-3,5-dinitrotoluene
IUPAC Name: 2-chloro-5-methyl-1,3-dinitrobenzene | CAS Registry Number: 5264-65-3
Synonyms: NCIOpen2_007318, 2-Chloro-5-methyl-1,3-dinitrobenzene, EINECS 226-080-9, NSC105591, ZINC01686606, Benzene, 2-chloro-5-methyl-1,3-dinitro-, MS-3686

Molecular Formula: C7H5ClN2O4Molecular Weight: 216.578600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JMDVARRGYWIJGZ-UHFFFAOYSA-N

• 5-Chloro-1,3-Xylene
IUPAC Name: 1-chloro-3,5-dimethylbenzene | CAS Registry Number: 556-97-8
Synonyms: 5-Chloro-m-xylene, m-Xylene, 5-chloro-, 1-Chloro-3,5-xylene, 5-Chloro-1,3-xylene, 3,5-Dimethylchlorobenzene, 3,5-Dimethylphenyl chloride, BRN 2039352, Benzene, 1-chloro-3,5-dimethyl-, CID32887, Benzene, 1-chloro-3,5-dimethyl- (9CI), LS-162591, 3-05-00-00834 (Beilstein Handbook Reference)

Molecular Formula: C8H9ClMolecular Weight: 140.610060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FKKLHLZFSZGXBN-UHFFFAOYSA-N

• 3-Fluorobenzhydrazide
IUPAC Name: 3-fluorobenzohydrazide | CAS Registry Number: 499-55-8
Synonyms: 3-Fluorobenzohydrazide, 3-Fluorobenzoic hydrazide, 536326_ALDRICH, NSC522533, CID351640, STK020472, ZINC00403973

Molecular Formula: C7H7FN2OMolecular Weight: 154.141683 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: UUISEXNUHLZEDB-UHFFFAOYSA-N

• 3-Carboxyphenyl isothiocyanate
IUPAC Name: 3-isothiocyanatobenzoic acid | CAS Registry Number: 2131-63-7
Synonyms: 3-Isothiocyanatobenzoic acid, Benzoic acid, 3-isothiocyanato-, NSC53162, ALBB-000195, CID75046

Molecular Formula: C8H5NO2SMolecular Weight: 179.195800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PJRBPKOOGLKPFB-UHFFFAOYSA-N

• 5-Chloro-2-iodotoluene
IUPAC Name: 4-chloro-1-iodo-2-methylbenzene | CAS Registry Number: 23399-70-4
Synonyms: 4-chloro-1-iodo-2-methylbenzene, benzene, 4-chloro-1-iodo-2-methyl-, 4-chloro-1-iodo-2-methyl-benzene, ACMC-20aich, SureCN395280, AC1MC40J, 4-Chloro-2-methyliodobenzene, KSC493K6N, CTK3J3566, MolPort-000-153-164, ACT08245, ANW-74703, ZINC02528202, AKOS009157513, AG-E-68195, AS00124, AK-34259, KB-73423, FT-0638318, ST51051896

Molecular Formula: C7H6ClIMolecular Weight: 252.480010 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZZNUQVQAJVZRKW-UHFFFAOYSA-N

• 1-(4-Carboxypheny)-2-thiourea
IUPAC Name: 4-(carbamothioylamino)benzoic acid | CAS Registry Number: 7366-56-5
Synonyms: Oprea1_411516, 4-(2-Thioureido)benzoic acid, AIDS114913, AIDS-114913, NSC49255, EINECS 230-910-5, 4-[(Aminothioxomethyl)amino]benzoic acid, ST5171239

Molecular Formula: C8H8N2O2SMolecular Weight: 196.226320 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: FOYDMXZTPAEILY-UHFFFAOYSA-N

• 2,4-Dihydroxybenzhydrazide
IUPAC Name: 2,4-dihydroxybenzohydrazide | CAS Registry Number: 13221-86-8
Synonyms: 2,4-dihydroxybenzohydrazide, Oprea1_781735, MLS000696965, 538582_ALDRICH, 2,4-Dihydroxybenzoic acid hydrazide, OWH-BC-1514, ALBB-002499, CID166785, STK414992, ZINC00401915, 2,4-Dihydroxybenzoic acid, hydrazide, Benzoic acid, 2,4-dihydroxy-, hydrazide, SMR000237724

Molecular Formula: C7H8N2O3Molecular Weight: 168.150020 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: GOPUHTXVZGIOHN-UHFFFAOYSA-N

• 3-Benzyloxyphenylacetonitrile
IUPAC Name: 2-(3-phenylmethoxyphenyl)acetonitrile | CAS Registry Number: 20967-96-8
Synonyms: 3-(Phenylmethoxy)-benzenemethanol, 2-(3-phenylmethoxyphenyl)acetonitrile, ST092372, 2-(3-(benzyloxy)phenyl)acetonitrile, 2-[3-(benzyloxy)phenyl]acetonitrile, 2-[3-(phenylmethoxy)phenyl]ethanenitrile, ZINC00092902, Maybridge3_000453, AC1LAT65, AC1Q4S1C, SureCN1636426, Oprea1_182015, ACMC-20a415, 3-benzyloxy-phenyl acetonitrile, CTK3J3543, MolPort-001-768-604, HMS1432E13, ANW-56151, SBB071431, 2-(3-phenylmethoxyphenyl)ethanenitrile

Molecular Formula: C15H13NOMolecular Weight: 223.269820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CKZFVIPFANUBDW-UHFFFAOYSA-N

• 5-Chlorosalicyl alcohol
IUPAC Name: 4-chloro-2-(hydroxymethyl)phenol | CAS Registry Number: 5330-38-1
Synonyms: Saligenin, 5-chloro-, NSC2468, Benzenemethanol, 5-chloro-2-hydroxy-, EINECS 226-225-6, ZINC00161715, AI3-24057, ST5410215

Molecular Formula: C7H7ClO2Molecular Weight: 158.582280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: AFPSETMCMFRVPG-UHFFFAOYSA-N

• 3-Chloro-2-Methylbenzonitrile
IUPAC Name: 3-chloro-2-methylbenzonitrile | CAS Registry Number: 54454-12-5
Synonyms: 3-Chloro-2-methylbenzonitrile, AG-F-89000, ST50824293, ZINC00167183, AC1LAVOI, PubChem23847, 3-Chloro-o-tolunitrile, ACMC-1AQTX, 2-Chloro-6-cyanotoluene, SureCN102325, 2-methyl-3-chlorobenzonitrile, CTK5A1086, Benzonitrile,3-chloro-2-methyl-, MolPort-000-153-224, 3-chloro-2-methylbenzenecarbonitrile, ANW-32088, CL8188, AKOS006228592, AG-A-58750, MCULE-8922348731

Molecular Formula: C8H6ClNMolecular Weight: 151.592940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FKFZTNLSUJCIMG-UHFFFAOYSA-N

• 4-Fluoro-2-methylphenyl isothiocyanate
IUPAC Name: 4-fluoro-1-isothiocyanato-2-methylbenzene | CAS Registry Number: 52317-97-2
Synonyms: 4-fluoro-1-isothiocyanato-2-methylbenzene, ZINC00162092, ACMC-1AW2W, AC1MC792, CTK4J5747, PC3823V, MolPort-000-155-720, 4-fluoro-2-methylbenzenisothiocyanate, ANW-22749, SBB088092, AKOS000212042, AG-F-78212, KB-38690, FT-0618459, 4-fluoranyl-1-isothiocyanato-2-methyl-benzene, C-5463, A829026, I09-2804

Molecular Formula: C8H6FNSMolecular Weight: 167.203343 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WFIPMZZOAIIOOG-UHFFFAOYSA-N

• 3,5-Dichlorofluorobenzene
IUPAC Name: 1,3-dichloro-5-fluorobenzene | CAS Registry Number: 1435-46-7
Synonyms: 1,3-Dichloro-5-fluorobenzene, Benzene,1,3-dichloro-5-fluoro-, 3,5-Dichloro-1-fluorobenzene, Benzene, 1,3-dichloro-5-fluoro-, TL8000959, 3S100866

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

InChIKey: BLWGKIXZAUOECS-UHFFFAOYSA-N

• 2-Bromo-4-chlorotoluene
IUPAC Name: 2-bromo-4-chloro-1-methylbenzene | CAS Registry Number: 27139-97-5
Synonyms: 2-Bromo-4-chloro-1-methylbenzene, Benzene, 2-bromo-4-chloro-1-methyl-, ST50826810, Toluene, 2-bromo-4-chloro-, PubChem3599, ACMC-209gvg, SureCN189010, AC1LD0G6, AC1Q2LX0, KSC493K9B, Jsp005286, 4-CHLORO-2-BROMOTOLUENE, CTK3J3590, ATTERCOP-CHM AT130705, MolPort-000-151-851, OTAVA-BB 1287423, ACN-S004600, ACT00717, 2-Bromo-4-chloro-1-methyl-benzene, ANW-26138

Molecular Formula: C7H6BrClMolecular Weight: 205.479540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CSUUXPHPCXHYGY-UHFFFAOYSA-N

• 4-Benzylphenylacetonitrile
IUPAC Name: 2-(4-benzylphenyl)acetonitrile | CAS Registry Number: 101096-72-4
Synonyms: 2-(4-benzylphenyl)acetonitrile, ST50408441, ZINC02528067, ACMC-20amog, AC1LCAC9, SureCN625190, AC1Q4S12, 2-[4-benzylphenyl]ethanenitrile, CTK3J3400, MolPort-000-151-449, AKOS015839222, AG-D-07438, MCULE-6328551617, KB-97613, FT-0617673, I14-26953, Acetonitrile,(a-phenyl-p-tolyl)- (6CI);(4-Benzylphenyl)acetonitrile;4-Benzylbenzyl cyanide;

Molecular Formula: C15H13NMolecular Weight: 207.270420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RNZDBGKQDKFAPR-UHFFFAOYSA-N

• 2,6-Diethylphenyl Isothiocyanate
IUPAC Name: 1,3-diethyl-2-isothiocyanatobenzene | CAS Registry Number: 25343-69-5
Synonyms: 2,6-Diethylphenyl isothiocyanate, 1,3-Diethyl-2-isothiocyanatobenzene, CHEBI:280483, ZINC02168487, CID141193, 1,3-Diethyl-2-isothiocyanato-benzene, T0517-7354

Molecular Formula: C11H13NSMolecular Weight: 191.292620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QDPPZHPTDMQNBE-UHFFFAOYSA-N

• 2-Fluoro-1,3-dimethylbenzene
IUPAC Name: 2-fluoro-1,3-dimethylbenzene | CAS Registry Number: 443-88-9
Synonyms: 2-Fluoro-m-xylene, 2,6-Dimethylfluorobenzene, 452866_ALDRICH, EINECS 207-144-5, JRD-1254, CID123065, CD 05584

Molecular Formula: C8H9FMolecular Weight: 124.155463 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JTAUTNBVFDTYTI-UHFFFAOYSA-N


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