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Search results for: '86847-79-2'
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5-[(2R)-pyrrolidin-2-yl]-2H-1,2,3,4-tetrazole
Cas Number: 702700-79-6Formula: C5H9N5Molecular weight: 139.1585Synonyms: 702700-79-6|(R)-5-(PYRROLIDIN-2-YL)-1H-TETRAZOLE|5-[(2R)-pyrrolidin-2-yl]-2H-1,2,3,4-tetrazole|1H-Te...SMILES: C1CC(NC1)C2=NNN=N2InChIKey: XUHYQIQIENDJER-SCSAIBSYSA-NInChI: InChI=1S/C5H9N5/c1-2-4(6-3-1)5-7-9-10-8-5/h4,6H,1-3H2,(H,7,8,9,10)/t4-/m1/s1
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Ethyl 3-bromo-6-hydroxypicolinate
Cas Number: 1214377-79-3Formula: C8H8BrNO3Molecular weight: 246.1Synonyms: Ethyl 3-bromo-6-hydroxypicolinate|1214377-79-3|Ethyl 3-bromo-6-oxo-1,6-dihydropyridine-2-carboxylate...SMILES: CCOC(=O)C1=C(C=CC(=O)N1)BrInChIKey: RPYJORIDPWCWOY-UHFFFAOYSA-NInChI: InChI=1S/C8H8BrNO3/c1-2-13-8(12)7-5(9)3-4-6(11)10-7/h3-4H,2H2,1H3,(H,10,11)
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N-Cyclohexyl 3-boronobenzenesulfonamide
Cas Number: 871329-79-2Formula: C12H18BNO4SMolecular weight: 283.2Synonyms: 871329-79-2|N-Cyclohexyl 3-boronobenzenesulfonamide|(3-(N-Cyclohexylsulfamoyl)phenyl)boronic acid|[3...SMILES: B(C1=CC(=CC=C1)S(=O)(=O)NC2CCCCC2)(O)OInChIKey: LSHHIHODRSZFHE-UHFFFAOYSA-NInChI: InChI=1S/C12H18BNO4S/c15-13(16)10-5-4-8-12(9-10)19(17,18)14-11-6-2-1-3-7-11/h4-5,8-9,11,14-16H,1-3,6-7H2
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Cobalt(II) carbonate
Cas Number: 513-79-1Formula: CoCO3Molecular weight: 118.94Synonyms: COBALT CARBONATE|Cobalt(II) carbonate|513-79-1|COBALTOUS CARBONATE|Cobalt(2+) carbonate|Sphaerocobal...SMILES: C(=O)([O-])[O-].[Co+2]InChIKey: ZOTKGJBKKKVBJZ-UHFFFAOYSA-LInChI: InChI=1S/CH2O3.Co/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2
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Xaliproden hydrochloride
Cas Number: 90494-79-4Formula: C24H22F3N•HClMolecular weight: 417.89Synonyms: NCGC00167574-01 | Xaliproden hydrochloride (JAN) | MS-27295 | Tox21_112567_1 | 1-[2-(2-naphthyl)ethy...SMILES: C1CN(CC=C1C2=CC(=CC=C2)C(F)(F)F)CCC3=CC4=CC=CC=C4C=C3.ClInChIKey: WVHBEIJGAINUBW-UHFFFAOYSA-NInChI: InChI=1S/C24H22F3N.ClH/c25-24(26,27)23-7-3-6-22(17-23)20-11-14-28(15-12-20)13-10-18-8-9-19-4-1-2-5-21(19)16-18;/h1-9,11,16-17H,10,12-15H2;1H
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N-Ethyl-p-menthane-3-carboxamide
Cas Number: 39711-79-0 EC Number: 254-599-0Formula: C13H25NOMolecular weight: 211.34Synonyms: 39711-79-0|N-Ethyl-p-menthane-3-carboxamide|N-Ethyl-2-isopropyl-5-methylcyclohexanecarboxamide|Ethyl...SMILES: CCNC(=O)C1CC(CCC1C(C)C)CInChIKey: VUNOFAIHSALQQH-UHFFFAOYSA-NInChI: InChI=1S/C13H25NO/c1-5-14-13(15)12-8-10(4)6-7-11(12)9(2)3/h9-12H,5-8H2,1-4H3,(H,14,15)
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5-Bromo-2-(4-methoxybenzyloxy)pyridine
Cas Number: 663955-79-1Formula: C13H12BrNO2Molecular weight: 294.1Synonyms: 663955-79-1|5-Bromo-2-((4-methoxybenzyl)oxy)pyridine|5-Bromo-2-(4-methoxybenzyloxy)pyridine|5-Bromo-...SMILES: COC1=CC=C(C=C1)COC2=NC=C(C=C2)BrInChIKey: NCWXAIKSFAEBJX-UHFFFAOYSA-NInChI: InChI=1S/C13H12BrNO2/c1-16-12-5-2-10(3-6-12)9-17-13-7-4-11(14)8-15-13/h2-8H,9H2,1H3
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2-Amino-N,N-diethylacetamide hydrochloride
Cas Number: 108723-79-1Formula: C6H15ClN2OMolecular weight: 166.65Synonyms: 2-Amino-N,N-diethylacetamide hydrochloride|108723-79-1|2-Amino-N,N-diethyl acetamide hydrochloride|2...SMILES: CCN(CC)C(=O)CN.ClInChIKey: RKWHGMGYRWKDSF-UHFFFAOYSA-NInChI: InChI=1S/C6H14N2O.ClH/c1-3-8(4-2)6(9)5-7;/h3-5,7H2,1-2H3;1H
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N,N-dimethyl-2-(piperidin-4-yl)acetamide hydrochloride
Cas Number: 1443980-79-7Formula: C9H18N2O•HClMolecular weight: 206.71Synonyms: AKOS015907716 | N,N-dimethyl-2-(4-piperidinyl)acetamide(SALTDATA: 2HCl) | PS-18067 | N,N-Dimethyl-2-...SMILES: CN(C)C(=O)CC1CCNCC1.ClInChIKey: CGQDDWZOJNIVPM-UHFFFAOYSA-NInChI: InChI=1S/C9H18N2O.ClH/c1-11(2)9(12)7-8-3-5-10-6-4-8;/h8,10H,3-7H2,1-2H3;1H
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2-(1,2,4-Triazol-1-yl)acetonitrile
Cas Number: 81606-79-3Formula: C4H4N4Molecular weight: 108.1Synonyms: 2-(1H-1,2,4-triazol-1-yl)acetonitrile|81606-79-3|2-(1,2,4-triazol-1-yl)acetonitrile|1H-1,2,4-Triazol...SMILES: C1=NN(C=N1)CC#NInChIKey: ZEDZBEBBGBQWBP-UHFFFAOYSA-NInChI: InChI=1S/C4H4N4/c5-1-2-8-4-6-3-7-8/h3-4H,2H2
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Ethyl 2-fluoro-5-nitrobenzoate
Cas Number: 367-79-3Formula: C9H8FNO4Molecular weight: 213.2Synonyms: ethyl 2-fluoro-5-nitrobenzoate|367-79-3|Ethyl 2-fluoro-5-nitrobenzenecarboxylate|MFCD06204381|AB2841...SMILES: CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])FInChIKey: UJIPWFPJAVYMHV-UHFFFAOYSA-NInChI: InChI=1S/C9H8FNO4/c1-2-15-9(12)7-5-6(11(13)14)3-4-8(7)10/h3-5H,2H2,1H3
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tert-butyl 3-(2-hydroxypropan-2-yl)azetidine-1-carboxylate
Cas Number: 1257293-79-0Formula: C11H21NO3Molecular weight: 215.29Synonyms: AC-31818 | CS-0048392 | DTXSID301132978 | SY067900 | 2-(1-Boc-3-azetidinyl)-2-propanol | 1257293-79-...SMILES: CC(C)(C)OC(=O)N1CC(C1)C(C)(C)OInChIKey: GMOIZAKBLSIACP-UHFFFAOYSA-NInChI: InChI=1S/C11H21NO3/c1-10(2,3)15-9(13)12-6-8(7-12)11(4,5)14/h8,14H,6-7H2,1-5H3
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2-Hydroxyquinoline-3-carboxylic acid
Cas Number: 2003-79-4Formula: C10H7NO3Molecular weight: 189.2Synonyms: 2003-79-4|2-hydroxyquinoline-3-carboxylic acid|2-Oxo-1,2-dihydro-quinoline-3-carboxylic acid|2-oxo-1...SMILES: C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)OInChIKey: XOQQVKDBGLYPGH-UHFFFAOYSA-NInChI: InChI=1S/C10H7NO3/c12-9-7(10(13)14)5-6-3-1-2-4-8(6)11-9/h1-5H,(H,11,12)(H,13,14)
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4-(4-(Trifluoromethyl)phenyl)thiazol-2-amine
Cas Number: 105512-79-6Formula: C10H7F3N2SMolecular weight: 244.24Synonyms: 105512-79-6|4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine|4-(4-Trifluoromethylphenyl)thiazol-2-y...SMILES: C1=CC(=CC=C1C2=CSC(=N2)N)C(F)(F)FInChIKey: HYAHAIVZFRFEBU-UHFFFAOYSA-NInChI: InChI=1S/C10H7F3N2S/c11-10(12,13)7-3-1-6(2-4-7)8-5-16-9(14)15-8/h1-5H,(H2,14,15)
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2-(2,5-Dichlorophenyl)acetic acid
Cas Number: 5398-79-8Formula: C8H6Cl2O2Molecular weight: 205.04Synonyms: 2-(2,5-dichlorophenyl)acetic acid|5398-79-8|2,5-DICHLOROPHENYLACETIC ACID|Benzeneacetic acid, 2,5-di...SMILES: C1=CC(=C(C=C1Cl)CC(=O)O)ClInChIKey: GWTUGCOXTFFBMM-UHFFFAOYSA-NInChI: InChI=1S/C8H6Cl2O2/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3H,4H2,(H,11,12)
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1-Benzyl-2-amino-3-tert-butoxycarbonyl-4,5-dimethylpyrrole
Cas Number: 100066-79-3Formula: C18H24N2O2Molecular weight: 300.4Synonyms: 1-Benzyl-2-amino-3-tert-butoxycarbonyl-4,5-dimethylpyrrole|100066-79-3|tert-butyl 2-amino-1-benzyl-4...SMILES: CC1=C(N(C(=C1C(=O)OC(C)(C)C)N)CC2=CC=CC=C2)CInChIKey: IIESIUNVGNNCNR-UHFFFAOYSA-NInChI: InChI=1S/C18H24N2O2/c1-12-13(2)20(11-14-9-7-6-8-10-14)16(19)15(12)17(21)22-18(3,4)5/h6-10H,11,19H2,1-5H3
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2-Amino-4-chlorothiazole-5-carbaldehyde
Cas Number: 76874-79-8Formula: C4H3ClN2OSMolecular weight: 162.6Synonyms: 2-Amino-4-chlorothiazole-5-carbaldehyde|76874-79-8|2-Amino-4-chloro-5-formylthiazole|2-amino-4-chlor...SMILES: C(=O)C1=C(N=C(S1)N)ClInChIKey: KJRBYUWRYRRPKN-UHFFFAOYSA-NInChI: InChI=1S/C4H3ClN2OS/c5-3-2(1-8)9-4(6)7-3/h1H,(H2,6,7)
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DL-Pantolactone
Cas Number: 79-50-5Formula: C6H10O3Molecular weight: 130.14Synonyms: DL-Pantolactone|79-50-5|3-hydroxy-4,4-dimethyldihydrofuran-2(3H)-one|3-hydroxy-4,4-dimethyloxolan-2-...SMILES: CC1(COC(=O)C1O)CInChIKey: SERHXTVXHNVDKA-UHFFFAOYSA-NInChI: InChI=1S/C6H10O3/c1-6(2)3-9-5(8)4(6)7/h4,7H,3H2,1-2H3
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Acrylic acid
Formula: C3H4O2Molecular weight: 72.06Synonyms: ACRYLIC ACID|2-Propenoic acid|79-10-7|prop-2-enoic acid|Vinylformic acid|Propenoic acid|Acroleic aci...SMILES: C=CC(=O)OInChIKey: NIXOWILDQLNWCW-UHFFFAOYSA-NInChI: InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)
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2-((5-Bromopyrimidin-2-yl)oxy)acetic acid
Cas Number: 270912-79-3Formula: C6H5BrN2O3Molecular weight: 233.02Synonyms: 2-((5-Bromopyrimidin-2-yl)oxy)acetic acid|270912-79-3|2-(5-bromopyrimidin-2-yl)oxyacetic acid|2-[(5-...SMILES: C1=C(C=NC(=N1)OCC(=O)O)BrInChIKey: YNKPSWPVUXFTJB-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrN2O3/c7-4-1-8-6(9-2-4)12-3-5(10)11/h1-2H,3H2,(H,10,11)
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Retinol palmitate
Formula: C36H60O2Molecular weight: 524.86Synonyms: retinyl palmitate|VITAMIN A PALMITATE|79-81-2|Retinol palmitate|Retinol, hexadecanoate|all-trans-Ret...SMILES: CCCCCCCCCCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(CCCC1(C)C)CInChIKey: VYGQUTWHTHXGQB-FFHKNEKCSA-NInChI: InChI=1S/C36H60O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-25-35(37)38-30-28-32(3)23-20-22-31(2)26-27-34-33(4)24-21-29-36(34,5)6/h20,22-23,26-28H,7-19,21,24-25,29-30H2,1-6H3/b23-20+,27-26+,31-22+,32-28+
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trans-1-benzhydryl-2-methyl-azetidine-3-carbonitrile
Cas Number: 159556-79-3Formula: C18H18N2Molecular weight: 262.35Synonyms: 159556-79-3 | rel-(2S,3R)-1-(Diphenylmethyl)-2-methylazetidine-3-carbonitrile | trans-1-benzhydryl-2...SMILES: CC1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)C#NInChIKey: FWCNLDUDKXUUDF-WMLDXEAASA-NInChI: InChI=1S/C18H18N2/c1-14-17(12-19)13-20(14)18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,14,17-18H,13H2,1H3/t14-,17+/m0/s1
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5-Chloroisoindoline hydrochloride
Cas Number: 912999-79-2Formula: C8H9Cl2NMolecular weight: 190.07Synonyms: 5-CHLOROISOINDOLINE HYDROCHLORIDE|912999-79-2|5-CHLOROISOINDOLINE HCL|5-Chloro-2,3-dihydro-1H-isoind...SMILES: C1C2=C(CN1)C=C(C=C2)Cl.ClInChIKey: SPDKLINCVDBABZ-UHFFFAOYSA-NInChI: InChI=1S/C8H8ClN.ClH/c9-8-2-1-6-4-10-5-7(6)3-8;/h1-3,10H,4-5H2;1H
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WAY-639760
Cas Number: 157862-79-8Formula: C20H16N4Molecular weight: 312.37Synonyms: N-benzyl-2-pyridin-3-ylquinazolin-4-amine|N-benzyl-2-(pyridin-3-yl)quinazolin-4-amine|76HY3LWB8V|CHE...SMILES: C1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4InChIKey: AELMNLIYFALJIR-UHFFFAOYSA-NInChI: InChI=1S/C20H16N4/c1-2-7-15(8-3-1)13-22-20-17-10-4-5-11-18(17)23-19(24-20)16-9-6-12-21-14-16/h1-12,14H,13H2,(H,22,23,24)
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