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Search results for: '96-19-5'
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1,2,3-Trichloropropene (cis- and trans- mixture)
Cas Number: 96-19-5Formula: C3H3Cl3Molecular weight: 145.41Synonyms: NSC 164001 | MFCD00018931 | WLN: G1YGU1G | 1,2,3-Trichlor-1-propene | Crystolon 39 | Cis-1,2,3-trich...SMILES: C(C(=CCl)Cl)ClInChIKey: HIILBTHBHCLUER-IWQZZHSRSA-NInChI: InChI=1S/C3H3Cl3/c4-1-3(6)2-5/h1H,2H2/b3-1-
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2-Amino-5-bromobenzonitrile
Cas Number: 39263-32-6 EC Number: 254-387-8Formula: C7H5BrN2Molecular weight: 197.03Synonyms: J-507912 | PD131300 | 5-Bromoanthranilonitrile | 5-bromo-anthranilonitrile | MB00791 | 2-amino-5-bro...SMILES: C1=CC(=C(C=C1Br)C#N)NInChIKey: OATYCBHROMXWJO-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2
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N-Methyl 5-bromopyridine-3-sulfonamide
Cas Number: 173999-19-4Formula: C6H7BrN2O2SMolecular weight: 251.1Synonyms: 5-Bromo-N-methylpyridine-3-sulfonamide|173999-19-4|N-Methyl 5-bromopyridine-3-sulfonamide|SCHEMBL177...SMILES: CNS(=O)(=O)C1=CC(=CN=C1)BrInChIKey: SNFZSCOGEYEYJG-UHFFFAOYSA-NInChI: InChI=1S/C6H7BrN2O2S/c1-8-12(10,11)6-2-5(7)3-9-4-6/h2-4,8H,1H3
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trans-Ned 19
Cas Number: 1354235-96-3Formula: C30H31FN4O3Molecular weight: 514.59Synonyms: trans-Ned-19 | 1354235-96-3 | Nicotinic acid adenine dinucleotide phosphate antagonist | SCHEMBL2016...SMILES: COC1=C(C=C(C=C1)C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3)CN5CCN(CC5)C6=CC=CC=C6FInChIKey: FUHCEERDBRGPQZ-LBNVMWSVSA-NInChI: See more
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5-(Ethoxycarbonyl)thiophene-3-boronic acid
Cas Number: 957121-19-6Formula: C7H9BO4SMolecular weight: 200Synonyms: 957121-19-6|(5-(Ethoxycarbonyl)thiophen-3-yl)boronic acid|5-(Ethoxycarbonyl)thiophene-3-boronic acid...SMILES: B(C1=CSC(=C1)C(=O)OCC)(O)OInChIKey: FIVYXNYCQWBICR-UHFFFAOYSA-NInChI: InChI=1S/C7H9BO4S/c1-2-12-7(9)6-3-5(4-13-6)8(10)11/h3-4,10-11H,2H2,1H3
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5-Fluoro-2-mercaptobenzoic acid
Cas Number: 120121-07-5Formula: C7H5FO2SMolecular weight: 172.18Synonyms: AKOS009157961 | A804436 | DTXSID40382615 | SCHEMBL1424485 | EN300-134812 | 5-fluorothiosalicylic Aci...SMILES: C1=CC(=C(C=C1F)C(=O)O)SInChIKey: WSOZOINWBSJTER-UHFFFAOYSA-NInChI: InChI=1S/C7H5FO2S/c8-4-1-2-6(11)5(3-4)7(9)10/h1-3,11H,(H,9,10)
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2-Bromo-5-iodoaniline
Cas Number: 111721-74-5Formula: C6H5BrINMolecular weight: 297.92Synonyms: MFCD16038675 | SCHEMBL4776655 | Z1037337332 | 2-bromo-5-iodoaniline | AS-813/43501704 | BenzenaMine,...SMILES: C1=CC(=C(C=C1I)N)BrInChIKey: LNVKBOZTHZJQLM-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrIN/c7-5-2-1-4(8)3-6(5)9/h1-3H,9H2
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3-Bromo-2，4，6-trimethylphenyl isocyanate
Cas Number: 480439-19-8Formula: C10H10BrNOMolecular weight: 240.1Synonyms: 3-Bromo-2,4,6-trimethylphenyl isocyanate|480439-19-8|2-bromo-4-isocyanato-1,3,5-trimethylbenzene|SCH...SMILES: CC1=CC(=C(C(=C1N=C=O)C)Br)CInChIKey: PXIWEPBSGPAODI-UHFFFAOYSA-NInChI: InChI=1S/C10H10BrNO/c1-6-4-7(2)10(12-5-13)8(3)9(6)11/h4H,1-3H3
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N-(3-Bromo-5-nitrobenzoyl)morpholine
Cas Number: 941294-19-5Formula: C11H11BrN2O4Molecular weight: 315.1Synonyms: 941294-19-5|(3-Bromo-5-nitrophenyl)(morpholino)methanone|N-(3-Bromo-5-nitrobenzoyl)morpholine|(3-bro...SMILES: C1COCCN1C(=O)C2=CC(=CC(=C2)Br)[N+](=O)[O-]InChIKey: RZUMLQTYOVVAIF-UHFFFAOYSA-NInChI: InChI=1S/C11H11BrN2O4/c12-9-5-8(6-10(7-9)14(16)17)11(15)13-1-3-18-4-2-13/h5-7H,1-4H2
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2-Chloro-5-(methylthio)benzoic acid
Cas Number: 51546-12-4Formula: C8H7ClO2SMolecular weight: 202.66Synonyms: 2-CHLORO-5-(METHYLTHIO)BENZOICACID | A7601 | 2-Chloro-5-(methylthio)benzoic acid, technical grade, 9...SMILES: CSC1=CC(=C(C=C1)Cl)C(=O)OInChIKey: HJDZJDJRUVAYTR-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClO2S/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)
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Decanoic Anhydride
Cas Number: 2082-76-0Formula: [CH3(CH2)8CO]2OMolecular weight: 326.51Synonyms: D89186 | DECANOIC ANHYDRIDE | EINECS 218-213-4 | n-decanoic anhydride | DTXSID80174935 | Capric anhy...SMILES: CCCCCCCCCC(=O)OC(=O)CCCCCCCCCInChIKey: HTWWKYKIBSHDPC-UHFFFAOYSA-NInChI: InChI=1S/C20H38O3/c1-3-5-7-9-11-13-15-17-19(21)23-20(22)18-16-14-12-10-8-6-4-2/h3-18H2,1-2H3
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ODM-203
Cas Number: 1430723-35-5Formula: C26H21F2N5O2SMolecular weight: 505.54Synonyms: 1430723-35-5 | AKOS040759188 | 1814961-19-7 | s8882 | ZJFCBQXPTQSTCZ-UHFFFAOYSA-N | N-(2',4'-Difluor...SMILES: CN1C=C(C=N1)C2=CC3=C(C=C2)N(C=N3)C4=CC(=CC(=C4)NS(=O)(=O)C5CC5)C6=C(C=C(C=C6)F)FInChIKey: ZJFCBQXPTQSTCZ-UHFFFAOYSA-NInChI: InChI=1S/C26H21F2N5O2S/c1-32-14-18(13-30-32)16-2-7-26-25(10-16)29-15-33(26)21-9-17(23-6-3-19(27)11-24(23)28)8-20(12-21)31-36(34,35)22-4-5-22/h2-3,6-15,22,31H,4-5H2,1H3
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1,3-Bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidene[2-(i-propoxy)-5-(N,N-dimethylaminosulfonyl)phenyl]methyleneruthenium (II) dichloride, Zhan Catalyst-1B
Cas Number: 918870-76-5Formula: C33H43Cl2N3O3RuSMolecular weight: 733.75Synonyms: D78537 | 1,3-Bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidene[2-(i-propoxy)-5-(N,N-dimethyla...SMILES: CC1=CC(=C(C(=C1)C)N2CCN(C2=[Ru](=CC3=C(C=CC(=C3)S(=O)(=O)N(C)C)OC(C)C)(Cl)Cl)C4=C(C=C(C=C4C)C)C)CInChIKey: OXLURKCRXVAJQS-UHFFFAOYSA-LInChI: See more
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(2-Fluoro-5-nitrophenyl)methanol
Cas Number: 63878-73-9Formula: C7H6FNO3Molecular weight: 171.1Synonyms: 1-fluoro-2-hydroxymethyl-4-nitrobenzene | 2-Fluoro-5-nitrobenzyl alcohol | DTXSID50403284 | 2-FLUORO...SMILES: C1=CC(=C(C=C1[N+](=O)[O-])CO)FInChIKey: IFIOUOYJVOSTFH-UHFFFAOYSA-NInChI: InChI=1S/C7H6FNO3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-3,10H,4H2
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tert-butyl 2-benzhydryl-5-oxa-2,8-diazaspiro[3.5]nonane-8-carboxylate
Cas Number: 1263268-96-7Formula: C24H30N2O3Molecular weight: 394.51Synonyms: tert-butyl 2-benzhydryl-5-oxa-2,8-diazaspiro[3.5]nonane-8-carboxylate | 1263268-96-7 | starbld004543...SMILES: CC(C)(C)OC(=O)N1CCOC2(C1)CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4InChIKey: HWJQWIACRRTINV-UHFFFAOYSA-NInChI: InChI=1S/C24H30N2O3/c1-23(2,3)29-22(27)25-14-15-28-24(16-25)17-26(18-24)21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21H,14-18H2,1-3H3
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5-Methoxy-1H-benzo[g]indole
Cas Number: 117461-83-3Formula: C13H11NOMolecular weight: 197.23Synonyms: starbld0037913 | 5-Methoxy-1H-benzo[g]indole | 5-methoxybenzindole | DTXSID70553634 | 1H-Benz[g]indo...SMILES: COC1=CC2=C(C3=CC=CC=C31)NC=C2InChIKey: DGGPMXAQMFWTBH-UHFFFAOYSA-NInChI: InChI=1S/C13H11NO/c1-15-12-8-9-6-7-14-13(9)11-5-3-2-4-10(11)12/h2-8,14H,1H3
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4-Methyl-3,5-dinitrobenzyl alcohol
Cas Number: 171809-20-4Formula: CH3C6H2(NO2)2CH2OHMolecular weight: 212.16Synonyms: AKOS022173724 | 4-METHYL-3 5-DINITROBENZYL ALCOHOL 96 | J-010760 | 4-Methyl-3,5-dinitrobenzylalcoho...SMILES: CC1=C(C=C(C=C1[N+](=O)[O-])CO)[N+](=O)[O-]InChIKey: CFABPPYLLXJWIW-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2O5/c1-5-7(9(12)13)2-6(4-11)3-8(5)10(14)15/h2-3,11H,4H2,1H3
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5-amino-1-methyl-piperidin-2-one;dihydrochloride
Cas Number: 1609400-96-5Formula: C6H12N2O·2[HCl]Molecular weight: 201.09Synonyms: 5-Amino-1-methylpiperidin-2-one dihydrochloride | 1609400-96-5 | 5-amino-1-methylpiperidin-2-one | d...SMILES: CN1CC(CCC1=O)N.Cl.ClInChIKey: AEKSLRDYWGDCMN-UHFFFAOYSA-NInChI: InChI=1S/C6H12N2O.2ClH/c1-8-4-5(7)2-3-6(8)9;;/h5H,2-4,7H2,1H3;2*1H
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2-(Methylsulfonyl)-5-(trifluoromethyl)aniline
Cas Number: 402-19-7Formula: C8H8F3NO2SMolecular weight: 239.2Synonyms: 2-(Methylsulfonyl)-5-(trifluoromethyl)aniline|402-19-7|2-methanesulfonyl-5-(trifluoromethyl)aniline|...SMILES: CS(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)NInChIKey: LNEFTABJIPDJBV-UHFFFAOYSA-NInChI: InChI=1S/C8H8F3NO2S/c1-15(13,14)7-3-2-5(4-6(7)12)8(9,10)11/h2-4H,12H2,1H3
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3-(3-Carboxyphenyl)-5-(trifluoromethyl)benzoic acid
Cas Number: 1261930-96-4Formula: C15H9F3O4Molecular weight: 310.2Synonyms: 1261930-96-4|3-(3-Carboxyphenyl)-5-(trifluoromethyl)benzoic acid|5-(Trifluoromethyl)-[1,1'-biphenyl]...SMILES: C1=CC(=CC(=C1)C(=O)O)C2=CC(=CC(=C2)C(F)(F)F)C(=O)OInChIKey: JWRDOJUKPATJKE-UHFFFAOYSA-NInChI: InChI=1S/C15H9F3O4/c16-15(17,18)12-6-10(5-11(7-12)14(21)22)8-2-1-3-9(4-8)13(19)20/h1-7H,(H,19,20)(H,21,22)
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(1R,4R,5S)-2-azabicyclo[2.2.1]heptan-5-ol;hydrochloride
Cas Number: 2757314-96-6Synonyms: (1R,4R,5S)-2-AZABICYCLO[2.2.1]HEPTAN-5-OL HYDROCHLORIDE | D79089 | 2757314-96-6SMILES: C1C2CC(C1CN2)O.ClInChIKey: LUTVSQCTGHUTOO-JMWSHJPJSA-NInChI: InChI=1S/C6H11NO.ClH/c8-6-2-5-1-4(6)3-7-5;/h4-8H,1-3H2;1H/t4-,5-,6+;/m1./s1
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3-Butoxy-5-(trifluoromethoxy)phenylboronic acid
Cas Number: 1256345-96-6Formula: C11H14BF3O4Molecular weight: 278Synonyms: 1256345-96-6|3-BUTOXY-5-(TRIFLUOROMETHOXY)PHENYLBORONIC ACID|(3-Butoxy-5-(trifluoromethoxy)phenyl)bo...SMILES: B(C1=CC(=CC(=C1)OC(F)(F)F)OCCCC)(O)OInChIKey: LJAITWONDCKJGB-UHFFFAOYSA-NInChI: InChI=1S/C11H14BF3O4/c1-2-3-4-18-9-5-8(12(16)17)6-10(7-9)19-11(13,14)15/h5-7,16-17H,2-4H2,1H3
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5-(4-Ethylpiperazin-1-yl)pyrimidine
Cas Number: 894853-96-4Formula: C10H16N4Molecular weight: 192.26Synonyms: 5-(4-Ethylpiperazin-1-yl)pyrimidine|894853-96-4|DTXSID80711506|MFCD26743619|AKOS016842699|DS-4787|CS...SMILES: CCN1CCN(CC1)C2=CN=CN=C2InChIKey: YHCSBMRTYDMQAG-UHFFFAOYSA-NInChI: InChI=1S/C10H16N4/c1-2-13-3-5-14(6-4-13)10-7-11-9-12-8-10/h7-9H,2-6H2,1H3
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5-[2-Chloro-5-(trifluoromethyl)phenyl]-2-furoic acid
Cas Number: 302911-88-2Formula: C12H6ClF3O3Molecular weight: 290.62Synonyms: AKOS000109302 | 5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-carboxylic Acid | 5-(2-CHLORO-5-(TRIFL...SMILES: C1=CC(=C(C=C1C(F)(F)F)C2=CC=C(O2)C(=O)O)ClInChIKey: SSIFVNBQAZVYCS-UHFFFAOYSA-NInChI: InChI=1S/C12H6ClF3O3/c13-8-2-1-6(12(14,15)16)5-7(8)9-3-4-10(19-9)11(17)18/h1-5H,(H,17,18)
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