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Search results for: '5493-45-8'
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1-(2-chlorophenyl)cyclopropan-1-amine hydrochloride
Cas Number: 1134699-45-8Formula: C9H11Cl2NMolecular weight: 204.1Synonyms: 1-(2-Chlorophenyl)cyclopropanamine hydrochloride|1134699-45-8|1-(2-Chlorophenyl)cyclopropan-1-amine ...SMILES: C1CC1(C2=CC=CC=C2Cl)N.ClInChIKey: ZWSHFWNTCCKFHL-UHFFFAOYSA-NInChI: InChI=1S/C9H10ClN.ClH/c10-8-4-2-1-3-7(8)9(11)5-6-9;/h1-4H,5-6,11H2;1H
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6-Methoxypyrimidine-4-carboxylic acid
Cas Number: 38214-45-8Formula: C6H6N2O3Molecular weight: 154.12Synonyms: 6-methoxypyrimidine-4-carboxylic Acid|38214-45-8|MFCD00496784|6-methoxy-4-Pyrimidinecarboxylic acid|...SMILES: COC1=NC=NC(=C1)C(=O)OInChIKey: GOLLRPFWZLSHBL-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O3/c1-11-5-2-4(6(9)10)7-3-8-5/h2-3H,1H3,(H,9,10)
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Diisopropyl phthalate
Formula: C14H18O4Molecular weight: 250.29Synonyms: DIISOPROPYL PHTHALATE|605-45-8|Phthalic acid, diisopropyl ester|DIISOPROPYLPHTHALATE|di-i-propyl pht...SMILES: CC(C)OC(=O)C1=CC=CC=C1C(=O)OC(C)CInChIKey: QWDBCIAVABMJPP-UHFFFAOYSA-NInChI: InChI=1S/C14H18O4/c1-9(2)17-13(15)11-7-5-6-8-12(11)14(16)18-10(3)4/h5-10H,1-4H3
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Hemicholinium-3, CHT
Formula: C24H34Br2N2O4Molecular weight: 574.35Synonyms: Hemicholinium-3|312-45-8|HEMICHOLINIUM 3|Hemicholinium bromide|Hemicholine|Hemicholinium dibromide|H...SMILES: C[N+]1(CCOC(C1)(C2=CC=C(C=C2)C3=CC=C(C=C3)C4(C[N+](CCO4)(C)C)O)O)C.[Br-].[Br-]InChIKey: OPYKHUMNFAMIBL-UHFFFAOYSA-LInChI: InChI=1S/C24H34N2O4.2BrH/c1-25(2)13-15-29-23(27,17-25)21-9-5-19(6-10-21)20-7-11-22(12-8-20)24(28)18-26(3,4)14-16-30-24;;/h5-12,27-28H,13-18H2,1-4H3;2*1H/q+2;;/p-2
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4-Formyl-3-methoxybenzonitrile
Cas Number: 21962-45-8Formula: C9H7NO2Molecular weight: 161.16Synonyms: 4-formyl-3-methoxybenzonitrile|21962-45-8|4-CYANO-2-METHOXYBENZALDEHYDE|2-methoxy-4-cyanobenzaldehyd...SMILES: COC1=C(C=CC(=C1)C#N)C=OInChIKey: ZXENVSJZOHXCKL-UHFFFAOYSA-NInChI: InChI=1S/C9H7NO2/c1-12-9-4-7(5-10)2-3-8(9)6-11/h2-4,6H,1H3
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methyl (2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizine-8-carboxylate
Cas Number: 2891580-45-1Formula: C9H14NO2FMolecular weight: 187.21Synonyms: 2891580-45-1 | methyl (2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizine-8-carboxylate | D78927 | MET...SMILES: COC(=O)C12CCCN1CC(C2)FInChIKey: FSIUNPRMYQMELM-APPZFPTMSA-NInChI: InChI=1S/C9H14FNO2/c1-13-8(12)9-3-2-4-11(9)6-7(10)5-9/h7H,2-6H2,1H3/t7-,9+/m1/s1
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2-(Aminooxy)ethanamine dihydrochloride
Cas Number: 37866-45-8Formula: C2H10Cl2N2OMolecular weight: 149.02Synonyms: 2-(Aminooxy)ethanamine dihydrochloride|37866-45-8|O-(2-aminoethyl)hydroxylamine dihydrochloride|2-am...SMILES: C(CON)N.Cl.ClInChIKey: VAWHTWXBNQFBAJ-UHFFFAOYSA-NInChI: InChI=1S/C2H8N2O.2ClH/c3-1-2-5-4;;/h1-4H2;2*1H
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1H-indazol-4-ol
Cas Number: 81382-45-8Formula: C7H6N2OMolecular weight: 134.138Synonyms: 1H-indazol-4-ol|81382-45-8|4-Hydroxy-1H-indazole|4-HYDROXYINDAZOLE|MFCD06858736|4-Hydroxyl-1H-indazo...SMILES: C1=CC2=C(C=NN2)C(=C1)OInChIKey: MPFDHICUUKUXLG-UHFFFAOYSA-NInChI: InChI=1S/C7H6N2O/c10-7-3-1-2-6-5(7)4-8-9-6/h1-4,10H,(H,8,9)
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2,4-dichloro-6-nitro-pyrrolo[2,1-f][1,2,4]triazine
Cas Number: 1160995-45-8Formula: C6H2N4O2Cl2Molecular weight: 233.01Synonyms: 1160995-45-8 | SY245074 | 2,4-Dichloro-6-nitropyrrolo[2,1-f][1,2,4]triazine | 2,4-DICHLORO-6-NITROPY...SMILES: C1=C2C(=NC(=NN2C=C1[N+](=O)[O-])Cl)ClInChIKey: UILXDKCIJUPNOF-UHFFFAOYSA-NInChI: InChI=1S/C6H2Cl2N4O2/c7-5-4-1-3(12(13)14)2-11(4)10-6(8)9-5/h1-2H
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2-(propan-2-yloxy)pyrimidine-5-carboxylic acid
Cas Number: 1072855-45-8Formula: C8H10N2O3Molecular weight: 182.18Synonyms: 2-(Propan-2-yloxy)pyrimidine-5-carboxylic acid | 1072855-45-8 | 2-isopropoxypyrimidine-5-carboxylic ...SMILES: CC(C)OC1=NC=C(C=N1)C(=O)OInChIKey: BVFBMMXABHHKSC-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2O3/c1-5(2)13-8-9-3-6(4-10-8)7(11)12/h3-5H,1-2H3,(H,11,12)
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3-(1H-Pyrazol-4-yl)aniline
Cas Number: 1170691-45-8Formula: C9H9N3Molecular weight: 159.18Synonyms: 3-(4-Pyrazolyl)aniline | VWB69145 | A1-20411 | FT-0769611 | SY147622 | Z1124713455 | 3-(1H-pyrazol-4...SMILES: C1=CC(=CC(=C1)N)C2=CNN=C2InChIKey: MSVASNFGSQCRCN-UHFFFAOYSA-NInChI: InChI=1S/C9H9N3/c10-9-3-1-2-7(4-9)8-5-11-12-6-8/h1-6H,10H2,(H,11,12)
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Ethidium bromide(EB)
Cas Number: 1239-45-8Formula: C21H20BrN3Molecular weight: 394.32Synonyms: ETHIDIUM BROMIDE|Homidium bromide|1239-45-8|Dromilac|EtBr|3,8-Diamino-5-ethyl-6-phenylphenanthridini...SMILES: CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[Br-]InChIKey: ZMMJGEGLRURXTF-UHFFFAOYSA-NInChI: InChI=1S/C21H19N3.BrH/c1-2-24-20-13-16(23)9-11-18(20)17-10-8-15(22)12-19(17)21(24)14-6-4-3-5-7-14;/h3-13,23H,2,22H2,1H3;1H
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2,3-Dihydrobenzofuran-7-carbaldehyde
Cas Number: 196799-45-8Formula: C9H8O2Molecular weight: 148.16Synonyms: 2,3-Dihydrobenzofuran-7-carbaldehyde|196799-45-8|2,3-dihydro-1-benzofuran-7-carbaldehyde|2,3-Dihydro...SMILES: C1COC2=C1C=CC=C2C=OInChIKey: CLXXUGOCVBQNAI-UHFFFAOYSA-NInChI: InChI=1S/C9H8O2/c10-6-8-3-1-2-7-4-5-11-9(7)8/h1-3,6H,4-5H2
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4-Bromospiro[fluorene-9,9'-xanthene]
Cas Number: 1609484-45-8Formula: C25H15BrOMolecular weight: 411.3Synonyms: 4-Bromo-spiro[9H-fluorene-9,9'-[9H]xanthene] | SCHEMBL15713407 | Spiro[9H-fluorene-9,9'-[9H]xanthene...SMILES: C1=CC=C2C(=C1)C3=C(C24C5=CC=CC=C5OC6=CC=CC=C46)C=CC=C3BrInChIKey: WQAGYCVGNQJYKT-UHFFFAOYSA-NInChI: InChI=1S/C25H15BrO/c26-21-13-7-12-20-24(21)16-8-1-2-9-17(16)25(20)18-10-3-5-14-22(18)27-23-15-6-4-11-19(23)25/h1-15H
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4,5-Dibromo-6-(trifluoromethyl)pyrimidine
Cas Number: 785777-94-8Formula: C5HBr2F3N2Molecular weight: 305.88Synonyms: 4,5-dibromo-6-(trifluoromethyl)pyrimidine|785777-94-8|DTXSID20458120|NLCUCCQCFKEKSF-UHFFFAOYSA-N|AMY...SMILES: C1=NC(=C(C(=N1)Br)Br)C(F)(F)FInChIKey: NLCUCCQCFKEKSF-UHFFFAOYSA-NInChI: InChI=1S/C5HBr2F3N2/c6-2-3(5(8,9)10)11-1-12-4(2)7/h1H
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anatibant, Bradykinin B2 receptor antagonist
Cas Number: 209733-45-9Formula: C34H36Cl2N6O5SMolecular weight: 711.7Synonyms: UNII-CLO4JRD21F | (2S)-N-(3-(4-Carbamimidoylbenzamido)propyl)-1-(2,4-dichloro-3-((2,4-dimethyl-8-qui...SMILES: CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NCCCNC(=O)C5=CC=C(C=C5)C(=N)N)Cl)CInChIKey: XUHBBTKJWIBQMY-MHZLTWQESA-NInChI: See more
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4-Chloro-2-iodopyrrolo[1,2-f][1,2,4]triazine
Cas Number: 1039364-45-8Formula: C6H3ClIN3Molecular weight: 279.47Synonyms: 1039364-45-8|4-chloro-2-iodopyrrolo[2,1-f][1,2,4]triazine|4-Chloro-2-iodopyrrolo[1,2-f][1,2,4]triazi...SMILES: C1=CN2C(=C1)C(=NC(=N2)I)ClInChIKey: ACSUHYOSODMNIG-UHFFFAOYSA-NInChI: InChI=1S/C6H3ClIN3/c7-5-4-2-1-3-11(4)10-6(8)9-5/h1-3H
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Ethyl 1h-indazole-4-carboxylate
Cas Number: 885279-45-8Formula: C10H10N2O2Molecular weight: 190.2Synonyms: ETHYL 1H-INDAZOLE-4-CARBOXYLATE|885279-45-8|MFCD07371611|1H-Indazole-4-carboxylic acid ethyl ester|E...SMILES: CCOC(=O)C1=C2C=NNC2=CC=C1InChIKey: ZYDRWPMGDIWCRN-UHFFFAOYSA-NInChI: InChI=1S/C10H10N2O2/c1-2-14-10(13)7-4-3-5-9-8(7)6-11-12-9/h3-6H,2H2,1H3,(H,11,12)
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1,3-Bis(2,4,6-trimethylphenyl)imidazolium chloride
Cas Number: 141556-45-8Formula: C21H25ClN2Molecular weight: 340.89Synonyms: 141556-45-8|1,3-Bis(2,4,6-trimethylphenyl)imidazolium chloride|1,3-Dimesityl-1H-imidazol-3-ium chlor...SMILES: CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)C3=C(C=C(C=C3C)C)C)C.[Cl-]InChIKey: OTOSIXGMLYKKOW-UHFFFAOYSA-MInChI: InChI=1S/C21H25N2.ClH/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;/h7-13H,1-6H3;1H/q+1;/p-1
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1H-1,3-Benzodiazol-5-yl(phenyl)methanamine
Cas Number: 929974-45-8Formula: C14H13N3Molecular weight: 223.3Synonyms: 929974-45-8|(1H-Benzo[d]imidazol-5-yl)(phenyl)methanamine|1H-1,3-Benzodiazol-5-yl(phenyl)methanamine...SMILES: C1=CC=C(C=C1)C(C2=CC3=C(C=C2)N=CN3)NInChIKey: CSGGYTQFKDJKFI-UHFFFAOYSA-NInChI: InChI=1S/C14H13N3/c15-14(10-4-2-1-3-5-10)11-6-7-12-13(8-11)17-9-16-12/h1-9,14H,15H2,(H,16,17)
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2-Amino-5-bromo-4-methoxypyrimidine
Cas Number: 36082-45-8Formula: C5H6BrN3OMolecular weight: 204Synonyms: 2-Amino-5-bromo-4-methoxypyrimidine|36082-45-8|5-bromo-4-methoxypyrimidin-2-amine|MFCD08460376|5-bro...SMILES: COC1=NC(=NC=C1Br)NInChIKey: YGRROWNSCFWHHN-UHFFFAOYSA-NInChI: InChI=1S/C5H6BrN3O/c1-10-4-3(6)2-8-5(7)9-4/h2H,1H3,(H2,7,8,9)
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Methyl acetoacetate
Formula: C5H8O3Molecular weight: 116.12Synonyms: CAS-105-45-3 | s3091 | Tox21_200162 | 3-Oxobutyric Acid Methyl Ester | 3-oxo-butyric acid methyl est...SMILES: CC(=O)CC(=O)OCInChIKey: WRQNANDWMGAFTP-UHFFFAOYSA-NInChI: InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3H2,1-2H3
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2-Amino-5-chloro-3-methylpyridine hemihydrate
Cas Number: 1173019-45-8Formula: C12H16Cl2N4OMolecular weight: 303.18Synonyms: 2-Amino-5-chloro-3-methylpyridine hemihydrate, 97% | 2-Amino-5-chloro-3-methylpyridine hemihydrate |...SMILES: CC1=CC(=CN=C1N)Cl.CC1=CC(=CN=C1N)Cl.OInChIKey: XUNMRTSHBBFPTI-UHFFFAOYSA-NInChI: InChI=1S/2C6H7ClN2.H2O/c2*1-4-2-5(7)3-9-6(4)8;/h2*2-3H,1H3,(H2,8,9);1H2
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1-(2-Chloropyridin-4-yl)piperazine
Cas Number: 854159-45-8Formula: C9H12ClN3Molecular weight: 197.67Synonyms: 1-(2-Chloropyridin-4-yl)piperazine|854159-45-8|1-(2-CHLORO-PYRIDIN-4-YL)-PIPERAZINE|MFCD06738480|SCH...SMILES: C1CN(CCN1)C2=CC(=NC=C2)ClInChIKey: CVBPSGWUINXSQC-UHFFFAOYSA-NInChI: InChI=1S/C9H12ClN3/c10-9-7-8(1-2-12-9)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2
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