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Search results for: '78316-08-2'
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3H-imidazo[4,5-b]pyridine-7-carboxylic acid
Cas Number: 78316-08-2Formula: C7H5N3O2Molecular weight: 163.136Synonyms: 3H-Imidazo[4,5-b]pyridine-7-carboxylic acid|78316-08-2|1H-imidazo[4,5-b]pyridine-7-carboxylic acid|3...SMILES: C1=CN=C2C(=C1C(=O)O)NC=N2InChIKey: CEZJOKOKGRAPMR-UHFFFAOYSA-NInChI: InChI=1S/C7H5N3O2/c11-7(12)4-1-2-8-6-5(4)9-3-10-6/h1-3H,(H,11,12)(H,8,9,10)
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Methyl 6-Chloronicotinate
Cas Number: 73781-91-6Formula: C7H6ClNO2Molecular weight: 171.58Synonyms: Methyl-6-chloronicotinate | methyl-6-chloro-nicotinate | 2F-320S | 2-chloro-5-methoxycarbonylpyridin...SMILES: COC(=O)C1=CN=C(C=C1)ClInChIKey: RMEDXVIWDFLGES-UHFFFAOYSA-NInChI: InChI=1S/C7H6ClNO2/c1-11-7(10)5-2-3-6(8)9-4-5/h2-4H,1H3
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2-Hydroxy-5-(hydroxymethyl)benzaldehyde
Cas Number: 74901-08-9Formula: C8H8O3Molecular weight: 152.15Synonyms: 2-hydroxy-5-(hydroxymethyl)benzaldehyde|74901-08-9|3-08-00-02136 (Beilstein Handbook Reference)|BENZ...SMILES: C1=CC(=C(C=C1CO)C=O)OInChIKey: MFHBKQHAPQBJFO-UHFFFAOYSA-NInChI: InChI=1S/C8H8O3/c9-4-6-1-2-8(11)7(3-6)5-10/h1-3,5,9,11H,4H2
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1-Butyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide
Cas Number: 350493-08-2Formula: C11H17F6N3O4S2Molecular weight: 433.38Synonyms: CAS-350493-08-2 | 1-Butyl-2,3-dimethylimidazolium bis(trifluoromethylsulfonyl)imide, H2O <500 ppm | ...SMILES: CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)FInChIKey: UCCKRVYTJPMHRO-UHFFFAOYSA-NInChI: InChI=1S/C9H17N2.C2F6NO4S2/c1-4-5-6-11-8-7-10(3)9(11)2;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h7-8H,4-6H2,1-3H3;/q+1;-1
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1-(3-Chloro-2-methylphenyl)piperidine
Cas Number: 1020253-08-0Formula: C12H16ClNMolecular weight: 209.7Synonyms: 1-(3-CHLORO-2-METHYLPHENYL)PIPERIDINE|1020253-08-0|DTXSID70591152|VQB25308|MFCD09972164|AKOS01584834...SMILES: CC1=C(C=CC=C1Cl)N2CCCCC2InChIKey: UQDJPOJUZFBCLB-UHFFFAOYSA-NInChI: InChI=1S/C12H16ClN/c1-10-11(13)6-5-7-12(10)14-8-3-2-4-9-14/h5-7H,2-4,8-9H2,1H3
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N-(2-Cyanoethyl)-4-(1,3,2-dioxaborinan-2-yl)benzamide
Cas Number: 1073372-08-3Formula: C13H15BN2O3Molecular weight: 258.1Synonyms: N-(2-Cyanoethyl)-4-(1,3,2-dioxaborinan-2-yl)benzamide|1073372-08-3|C13H15BN2O3|DTXSID00674609|MFCD11...SMILES: B1(OCCCO1)C2=CC=C(C=C2)C(=O)NCCC#NInChIKey: PFLGLNOIHGMWPX-UHFFFAOYSA-NInChI: InChI=1S/C13H15BN2O3/c15-7-1-8-16-13(17)11-3-5-12(6-4-11)14-18-9-2-10-19-14/h3-6H,1-2,8-10H2,(H,16,17)
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1-Ethoxy-2-nitro-4-(trifluoromethyl)benzene
Cas Number: 655-08-3Formula: C9H8F3NO3Molecular weight: 235.2Synonyms: 1-ETHOXY-2-NITRO-4-(TRIFLUOROMETHYL)BENZENE|655-08-3|SCHEMBL10665310|DTXSID60589568|AKLSDZQCGRHYNP-U...SMILES: CCOC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]InChIKey: AKLSDZQCGRHYNP-UHFFFAOYSA-NInChI: InChI=1S/C9H8F3NO3/c1-2-16-8-4-3-6(9(10,11)12)5-7(8)13(14)15/h3-5H,2H2,1H3
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ethyl 2-(1-cyanocyclopropyl)acetate
Cas Number: 1461715-08-1Formula: C8H11NO2Molecular weight: 153.18Synonyms: ethyl 2-(1-cyanocyclopropyl)acetate | 1461715-08-1 | SCHEMBL9209379 | ethyl2-(1-cyanocyclopropyl)ace...SMILES: CCOC(=O)CC1(CC1)C#NInChIKey: FOYVHLRKRLXXEM-UHFFFAOYSA-NInChI: InChI=1S/C8H11NO2/c1-2-11-7(10)5-8(6-9)3-4-8/h2-5H2,1H3
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2-Amino-4-bromo-6-nitrophenol
Cas Number: 139138-08-2Formula: C6H5BrN2O3Molecular weight: 233.02Synonyms: 2-amino-4-bromo-6-nitrophenol|139138-08-2|Phenol, 2-amino-4-bromo-6-nitro-|NSC51770|DTXSID90407645|M...SMILES: C1=C(C=C(C(=C1N)O)[N+](=O)[O-])BrInChIKey: SAOMJFDQNMQPJJ-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrN2O3/c7-3-1-4(8)6(10)5(2-3)9(11)12/h1-2,10H,8H2
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3,5-Difluoro-2-Methoxybenzonitrile
Cas Number: 886496-72-6Formula: C8H5F2NOMolecular weight: 169.131Synonyms: 3,5-Difluoro-2-methoxybenzonitrile|874804-08-7|MFCD06409085|DTXSID901296097|3,5-Difluoro-2-methoxy-b...
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3-methyl-7-(trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one
Cas Number: 146741-08-4Formula: C10H9N2OF3Molecular weight: 230.19Synonyms: 3-methyl-7-(trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one | 146741-08-4 | MFCD11901167 | PB40735 ...SMILES: CC1C(=O)NC2=C(N1)C=CC(=C2)C(F)(F)FInChIKey: WKAFVRQFNIJFPA-UHFFFAOYSA-NInChI: InChI=1S/C10H9F3N2O/c1-5-9(16)15-8-4-6(10(11,12)13)2-3-7(8)14-5/h2-5,14H,1H3,(H,15,16)
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2-bromo-2-(2-bromophenyl)acetic acid
Cas Number: 134770-08-4Formula: C8H6O2Br2Molecular weight: 293.94Synonyms: 2-bromo-2-(2-bromophenyl)acetic acid | 134770-08-4 | Benzeneacetic acid, a,2-dibromo- | SCHEMBL81330...SMILES: C1=CC=C(C(=C1)C(C(=O)O)Br)BrInChIKey: MSQRTBNBJISKGJ-UHFFFAOYSA-NInChI: InChI=1S/C8H6Br2O2/c9-6-4-2-1-3-5(6)7(10)8(11)12/h1-4,7H,(H,11,12)
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2-(3,3-difluorocyclobutyl)acetaldehyde
Cas Number: 1374657-08-5Formula: C6H8F2OMolecular weight: 134.12Synonyms: 2-(3,3-difluorocyclobutyl)acetaldehyde | 1374657-08-5 | SCHEMBL15922574 | AMY35760 | ZEC65708 | MFCD...SMILES: C1C(CC1(F)F)CC=OInChIKey: CRKBNRQSAKCDPE-UHFFFAOYSA-NInChI: InChI=1S/C6H8F2O/c7-6(8)3-5(4-6)1-2-9/h2,5H,1,3-4H2
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2-Bromo-4,5-dimethyloxazole
Cas Number: 1240612-08-1 EC Number: ‘818-241-2Formula: C5H6BrNOMolecular weight: 176.01Synonyms: A890603 | AT18457 | W-205186 | AKOS015994846 | J-508260 | Oxazole, 2-bromo-4,5-dimethyl- | 2-Bromo-4...SMILES: CC1=C(OC(=N1)Br)CInChIKey: QDVISYCNCKXBLV-UHFFFAOYSA-NInChI: InChI=1S/C5H6BrNO/c1-3-4(2)8-5(6)7-3/h1-2H3
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2-Methoxybenzyl isocyanate
Cas Number: 93489-08-8Formula: C9H9NO2Molecular weight: 163.17Synonyms: 2-Methoxybenzyl isocyanate|93489-08-8|1-(isocyanatomethyl)-2-methoxybenzene|2-Methoxybenzylisocyanat...SMILES: COC1=CC=CC=C1CN=C=OInChIKey: DTKFYMTVYBPJRC-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO2/c1-12-9-5-3-2-4-8(9)6-10-7-11/h2-5H,6H2,1H3
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Ethyl Propargylate-¹³C3
Cas Number: 1173019-08-3Formula: C213C3H6O2Molecular weight: 101.08Synonyms: Ethyl (~13~C_3_)prop-2-ynoate | Ethyl propiolate-13C3, 99 atom % 13C, 97% (CP) | 1173019-08-3 | DTXS...SMILES: CCOC(=O)C#CInChIKey: FMVJYQGSRWVMQV-CGANOEODSA-NInChI: InChI=1S/C5H6O2/c1-3-5(6)7-4-2/h1H,4H2,2H3/i1+1,3+1,5+1
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tert-butyl 2-(hydroxymethyl)-5-methyl-piperazine-1-carboxylate
Cas Number: 2739789-08-1Formula: C11H22N2O3Molecular weight: 230.3Synonyms: F89931 | tert-butyl 2-(hydroxymethyl)-5-methylpiperazine-1-carboxylate | TERT-BUTYL 2-(HYDROXYMETHYL...SMILES: CC1CN(C(CN1)CO)C(=O)OC(C)(C)CInChIKey: DJOCAAOGXLQNOD-UHFFFAOYSA-NInChI: InChI=1S/C11H22N2O3/c1-8-6-13(9(7-14)5-12-8)10(15)16-11(2,3)4/h8-9,12,14H,5-7H2,1-4H3
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(2S)-4-benzyl-2-(benzyloxymethyl)-1,4-oxazepane
Cas Number: 1802150-08-8Formula: C20H25NO2Molecular weight: 311.42Synonyms: (2S)-4-benzyl-2-(benzyloxymethyl)-1,4-oxazepane | 1802150-08-8 | (S)-4-Benzyl-2-((benzyloxy)methyl)-...SMILES: C1CN(CC(OC1)COCC2=CC=CC=C2)CC3=CC=CC=C3InChIKey: RKDIYYMKTOOITR-FQEVSTJZSA-NInChI: InChI=1S/C20H25NO2/c1-3-8-18(9-4-1)14-21-12-7-13-23-20(15-21)17-22-16-19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2/t20-/m0/s1
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2-Fluoro-6-(trifluoromethyl)benzoic Anhydride
Cas Number: 2118332-08-2Formula: C16H6F8O3Molecular weight: 398.21Synonyms: F1184 | T72072 | 2118332-08-2 | [2-fluoro-6-(trifluoromethyl)benzoyl] 2-fluoro-6-(trifluoromethyl)be...SMILES: C1=CC(=C(C(=C1)F)C(=O)OC(=O)C2=C(C=CC=C2F)C(F)(F)F)C(F)(F)FInChIKey: WBQMFZFVXXISMA-UHFFFAOYSA-NInChI: InChI=1S/C16H6F8O3/c17-9-5-1-3-7(15(19,20)21)11(9)13(25)27-14(26)12-8(16(22,23)24)4-2-6-10(12)18/h1-6H
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2-Acetamido-5-chloroisonicotinic acid
Cas Number: 944390-08-3Formula: C8H7ClN2O3Molecular weight: 214.6Synonyms: 2-ACETAMIDO-5-CHLOROISONICOTINIC ACID|944390-08-3|2-acetamido-5-chloropyridine-4-carboxylic acid|2-A...SMILES: CC(=O)NC1=NC=C(C(=C1)C(=O)O)ClInChIKey: ORAHTDAWLWQGPL-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClN2O3/c1-4(12)11-7-2-5(8(13)14)6(9)3-10-7/h2-3H,1H3,(H,13,14)(H,10,11,12)
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5-fluoro-4-iodo-2-methylaniline
Cas Number: 307306-08-7Formula: C7H7NFIMolecular weight: 251.03Synonyms: 5-Fluoro-4-iodo-2-methylaniline|307306-08-7|Benzenamine, 5-fluoro-4-iodo-2-methyl-|SCHEMBL15575436|D...SMILES: CC1=CC(=C(C=C1N)F)IInChIKey: SOOKBJGPYYCNEA-UHFFFAOYSA-NInChI: InChI=1S/C7H7FIN/c1-4-2-6(9)5(8)3-7(4)10/h2-3H,10H2,1H3
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Heparin sodium salt
Cas Number: 9041-08-1Synonyms: Heparin, sodium salt|9041-08-1|Nadroparin Sodium|Heparin sodium salt (MW 15kDa)|sodium;2-[3,5-bis(2-...SMILES: C1N(CN(CN1CCO)CC[O-])CCO.[Na+]InChIKey: YOMTXLQWRQUKAK-UHFFFAOYSA-NInChI: InChI=1S/C9H20N3O3.Na/c13-4-1-10-7-11(2-5-14)9-12(8-10)3-6-15;/h13-14H,1-9H2;/q-1;+1
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2-bromo-1,5-difluoro-3-methylbenzene
Cas Number: 1807135-08-5Formula: C7H5BrF2Molecular weight: 207.02Synonyms: 1807135-08-5 | 2-bromo-1,5-difluoro-3-methylbenzene | 2-Bromo-3,5-difluorotoluene | Benzene, 2-bromo...SMILES: CC1=CC(=CC(=C1Br)F)FInChIKey: AWDCMWWKXLOYNE-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrF2/c1-4-2-5(9)3-6(10)7(4)8/h2-3H,1H3
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