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Search results for: '1190788-52-3'
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Diethyl (phenylthiomethyl⁻¹³C)phosphonate
Cas Number: 1190788-52-3Formula: C11H17O3PSMolecular weight: 260.29Synonyms: Diethyl ((phenylthio)methyl)phosphonate | Diethyl (phenylsulfanyl)methylphosphonate | AS-62470 | MFC...SMILES: CCOP(=O)(CSC1=CC=CC=C1)OCCInChIKey: FBUXEPJJFVDUFE-UHFFFAOYSA-NInChI: InChI=1S/C11H17O3PS/c1-3-13-15(12,14-4-2)10-16-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
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NG 52, Inhibitor of cyclin dependent kinase 1;Inhibitor of glycogen synthase kinase 3 beta
Cas Number: 212779-48-1Formula: C16H19ClN6OMolecular weight: 346.81Synonyms: 212779-48-1|NG 52|compound 52|NG-52|2-(2-HYDROXYETHYLAMINO)-6-(3-CHLOROANILINO)-9-ISOPROPYLPURINE|2-...SMILES: CC(C)N1C=NC2=C(N=C(N=C21)NCCO)NC3=CC(=CC=C3)ClInChIKey: XZEFMZCNXDQXOZ-UHFFFAOYSA-NInChI: InChI=1S/C16H19ClN6O/c1-10(2)23-9-19-13-14(20-12-5-3-4-11(17)8-12)21-16(18-6-7-24)22-15(13)23/h3-5,8-10,24H,6-7H2,1-2H3,(H2,18,20,21,22)
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PCB No 52 standard solution
Cas Number: 35693-99-3Formula: C12H6Cl4Molecular weight: 291.99Synonyms: 2,2',5,5'-TETRACHLOROBIPHENYL|35693-99-3|1,1'-Biphenyl, 2,2',5,5'-tetrachloro-|PCB 52|2,5,2',5'-Tetr...SMILES: C1=CC(=C(C=C1Cl)C2=C(C=CC(=C2)Cl)Cl)ClInChIKey: HCWZEPKLWVAEOV-UHFFFAOYSA-NInChI: InChI=1S/C12H6Cl4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6H
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4-Amino-1H-pyrazole-3-carboxylic acid
Cas Number: 116008-52-7Formula: C4H5N3O2Molecular weight: 127.1Synonyms: 4-Amino-1H-pyrazole-3-carboxylic acid|116008-52-7|4-Amino-1H-pyrazole-5-carboxylic acid|1H-Pyrazole-...SMILES: C1=NNC(=C1N)C(=O)OInChIKey: SHRRRNSPESGSCM-UHFFFAOYSA-NInChI: InChI=1S/C4H5N3O2/c5-2-1-6-7-3(2)4(8)9/h1H,5H2,(H,6,7)(H,8,9)
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2-(dimethoxymethyl)-6-(methylamino)pyridine-3-carbaldehyde
Cas Number: 2227206-52-0Formula: C10H14N2O3Molecular weight: 210.23Synonyms: 2-(dimethoxymethyl)-6-(methylamino)pyridine-3-carbaldehyde | 2227206-52-0 | MFCD31695975 | PB42029 |...SMILES: CNC1=NC(=C(C=C1)C=O)C(OC)OCInChIKey: NDNMUQQBOAUKPO-UHFFFAOYSA-NInChI: InChI=1S/C10H14N2O3/c1-11-8-5-4-7(6-13)9(12-8)10(14-2)15-3/h4-6,10H,1-3H3,(H,11,12)
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1-[3-bromo-2-hydroxy-5-(trifluoromethyl)phenyl]ethanone
Cas Number: 1897342-52-7Formula: C9H6O2F3BrMolecular weight: 283.04Synonyms: 1-[3-bromo-2-hydroxy-5-(trifluoromethyl)phenyl]ethanone | 1897342-52-7 | SCHEMBL23887001 | F89994SMILES: CC(=O)C1=C(C(=CC(=C1)C(F)(F)F)Br)OInChIKey: ZKFICJCYSNXPBB-UHFFFAOYSA-NInChI: InChI=1S/C9H6BrF3O2/c1-4(14)6-2-5(9(11,12)13)3-7(10)8(6)15/h2-3,15H,1H3
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2-[3-(methoxymethoxy)-1-naphthyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Cas Number: 2378262-52-1Formula: C18H23BO4Molecular weight: 314.18Synonyms: F89103 | 2-(3-(METHOXYMETHOXY)NAPHTHALEN-1-YL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE | 2378262-52-...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC3=CC=CC=C23)OCOCInChIKey: TXUDWMAZCPSDKG-UHFFFAOYSA-NInChI: InChI=1S/C18H23BO4/c1-17(2)18(3,4)23-19(22-17)16-11-14(21-12-20-5)10-13-8-6-7-9-15(13)16/h6-11H,12H2,1-5H3
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(2S,3R)-2-methylpiperidin-3-ol
Cas Number: 941715-52-2Formula: C6H13NOMolecular weight: 115.18Synonyms: (2S,3R)-2-methylpiperidin-3-ol | 941715-52-2 | 2beta-Methylpiperidine-3alpha-ol | AKOS006353402 | D9...SMILES: CC1C(CCCN1)OInChIKey: YAMQDSQNPDUGGS-NTSWFWBYSA-NInChI: InChI=1S/C6H13NO/c1-5-6(8)3-2-4-7-5/h5-8H,2-4H2,1H3/t5-,6+/m0/s1
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1-(3-CHLOROPHENYL)-5-METHYL-1H-PYRAZOLE-4-CARBOHYDRAZIDE
Cas Number: 618092-52-7Formula: C11H11ClN4OMolecular weight: 250.69Synonyms: 1-(3-CHLOROPHENYL)-5-METHYL-1H-PYRAZOLE-4-CARBOHYDRAZIDE|618092-52-7|1-(3-chlorophenyl)-5-methylpyra...SMILES: CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NNInChIKey: MFDNABOMHGJFFI-UHFFFAOYSA-NInChI: InChI=1S/C11H11ClN4O/c1-7-10(11(17)15-13)6-14-16(7)9-4-2-3-8(12)5-9/h2-6H,13H2,1H3,(H,15,17)
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3-Chloro-N,2-dimethylaniline
Cas Number: 41456-52-4Formula: C8H10ClNMolecular weight: 155.6Synonyms: 3-chloro-n,2-dimethylaniline|41456-52-4|3-Chloro-2,N-dimethylaniline|SCHEMBL9232217|DTXSID80562232|M...SMILES: CC1=C(C=CC=C1Cl)NCInChIKey: XAEPSTFCZJTYLE-UHFFFAOYSA-NInChI: InChI=1S/C8H10ClN/c1-6-7(9)4-3-5-8(6)10-2/h3-5,10H,1-2H3
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cis-3-(hydroxymethyl)cyclopentanol
Cas Number: 111292-52-5Formula: C6H12O2Molecular weight: 116.16Synonyms: cis-3-(Hydroxymethyl)cyclopentanol | 111292-52-5 | (1S,3R)-3-(Hydroxymethyl)cyclopentan-1-ol | 19326...SMILES: C1CC(CC1CO)OInChIKey: ZBAXTIFHKIGLEJ-RITPCOANSA-NInChI: InChI=1S/C6H12O2/c7-4-5-1-2-6(8)3-5/h5-8H,1-4H2/t5-,6+/m1/s1
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3-(3-fluorophenyl)oxetane-3-carboxylic acid
Cas Number: 1393553-52-0Formula: C10H9FO3Molecular weight: 196.18Synonyms: 3-(3-FLUOROPHENYL)OXETANE-3-CARBOXYLIC ACID | 1393553-52-0 | MFCD22546746 | AKOS023207211 | AB82463 ...SMILES: C1C(CO1)(C2=CC(=CC=C2)F)C(=O)OInChIKey: YBHGVJBNBLKZGB-UHFFFAOYSA-NInChI: InChI=1S/C10H9FO3/c11-8-3-1-2-7(4-8)10(9(12)13)5-14-6-10/h1-4H,5-6H2,(H,12,13)
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2-Bromo-5-iodopyridin-3-ol
Cas Number: 1142191-52-3Formula: C5H3BrINOMolecular weight: 299.89Synonyms: DTXSID80673892 | 2-Bromo-5-iodopyridin-3-ol | 1142191-52-3 | MFCD12026744 | SCHEMBL15475425 | 2-Brom...SMILES: C1=C(C=NC(=C1O)Br)IInChIKey: IWBJXACFIJFJHB-UHFFFAOYSA-NInChI: InChI=1S/C5H3BrINO/c6-5-4(9)1-3(7)2-8-5/h1-2,9H
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4,6-difluoropyridin-3-ol
Cas Number: 1227597-52-5Formula: C5H3NOF2Molecular weight: 131.08Synonyms: 4,6-Difluoropyridin-3-ol | 1227597-52-5 | MFCD16610802 | 2,4-Difluoro-5-hydroxypyridine | AS-39386 |...SMILES: C1=C(C(=CN=C1F)O)FInChIKey: AWZXKMWNYBJVLA-UHFFFAOYSA-NInChI: InChI=1S/C5H3F2NO/c6-3-1-5(7)8-2-4(3)9/h1-2,9H
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methyl 2-(tert-butoxycarbonylamino)-3-(1-methylpyrazol-4-yl)propanoate
Cas Number: 2139121-52-9Formula: C13H21N3O4Molecular weight: 283.32Synonyms: 2139121-52-9 | E83505 | METHYL 2-((TERT-BUTOXYCARBONYL)AMINO)-3-(1-METHYL-1H-PYRAZOL-4-YL)PROPANOATESMILES: CC(C)(C)OC(=O)NC(CC1=CN(N=C1)C)C(=O)OCInChIKey: COUGNJPPLSMLHI-UHFFFAOYSA-NInChI: InChI=1S/C13H21N3O4/c1-13(2,3)20-12(18)15-10(11(17)19-5)6-9-7-14-16(4)8-9/h7-8,10H,6H2,1-5H3,(H,15,18)
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3-(Difluoromethyl)-1-fluorobenzene
Cas Number: 26029-52-7Formula: C7H5F3Molecular weight: 146.11Synonyms: 26029-52-7|1-(difluoromethyl)-3-fluorobenzene|3-(difluoromethyl)-1-fluorobenzene|3-(Difluoromethyl)f...SMILES: C1=CC(=CC(=C1)F)C(F)FInChIKey: IKCXLEHVIIUYOA-UHFFFAOYSA-NInChI: InChI=1S/C7H5F3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,7H
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3-(Methylamino)benzonitrile
Cas Number: 64910-52-7Formula: C8H8N2Molecular weight: 132.16Synonyms: 3-(methylamino)benzonitrile|64910-52-7|Benzonitrile, 3-(methylamino)-|3-methylaminobenzonitrile|SCHE...SMILES: CNC1=CC=CC(=C1)C#NInChIKey: XLZUKBAAILMFSU-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2/c1-10-8-4-2-3-7(5-8)6-9/h2-5,10H,1H3
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Tetrahydrofluoroene 52, Estrogen receptor agonist
Cas Number: 1398510-92-3Formula: C25H27N3O2Molecular weight: 401.5Synonyms: Tetrahydrofluoroene 52 | HY-100327 | (9aS)-3-tert-butyl-9a-(2-phenoxyethyl)-9,10-dihydro-8H-indeno[2...SMILES: CC(C)(C)N1C2=C(C3=C(C=C2)C4=CC(=O)CCC4(C3)CCOC5=CC=CC=C5)N=N1InChIKey: LYLIIGQPIKTONH-RUZDIDTESA-NInChI: InChI=1S/C25H27N3O2/c1-24(2,3)28-22-10-9-19-20(23(22)26-27-28)16-25(12-11-17(29)15-21(19)25)13-14-30-18-7-5-4-6-8-18/h4-10,15H,11-14,16H2,1-3H3/t25-/m1/s1
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3-(3-Fluorophenyl)-isoxazole-5-carbaldehyde
Cas Number: 885273-52-9Formula: C10H6FNO2Molecular weight: 191.2Synonyms: 885273-52-9|3-(3-Fluorophenyl)isoxazole-5-carbaldehyde|3-(3-FLUORO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE|...SMILES: C1=CC(=CC(=C1)F)C2=NOC(=C2)C=OInChIKey: FMVCEZDURIQSCF-UHFFFAOYSA-NInChI: InChI=1S/C10H6FNO2/c11-8-3-1-2-7(4-8)10-5-9(6-13)14-12-10/h1-6H
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1-Bromo-1,1,2,2,4,5,5,7,8,8,10,11,11,13,14,14,16,16,17,17,17-henicosafluoro-4,7,10,13-tetrakis(trifluoromethyl)-3,6,9,12,15-pentaoxaheptadecane
Cas Number: 1482416-52-3Formula: C16BrF33O5Molecular weight: 979.02Synonyms: AKOS037621827 | B4167 | 1-Bromo-1,1,2,2,4,5,5,7,8,8,10,11,11,13,14,14,16,16,17,17,17-henicosafluoro-...SMILES: C(C(OC(C(OC(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)Br)(F)F)F)(F)F)F)(F)F)FInChIKey: VAXWUAHPDZRLAP-UHFFFAOYSA-NInChI: InChI=1S/C16BrF33O5/c17-5(22,23)15(47,48)54-3(20,8(30,31)32)13(43,44)52-1(18,6(24,25)26)11(39,40)51-2(19,7(27,28)29)12(41,42)53-4(21,9(33,34)35)14(45,46)55-16(49,50)10(36,37)38
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3-(3-bromophenyl)oxetane
Cas Number: 1044507-52-9Formula: C9H9BrOMolecular weight: 213.074Synonyms: 3-(3-Bromophenyl)oxetane|1044507-52-9|3-(3-Bromo-phenyl)-oxetane|SCHEMBL1810741|DTXSID90703912|IKNHA...SMILES: C1C(CO1)C2=CC(=CC=C2)BrInChIKey: IKNHAXGIHOUCCX-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrO/c10-9-3-1-2-7(4-9)8-5-11-6-8/h1-4,8H,5-6H2
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2-(4-amino-3-methyl-pyrazol-1-yl)-2-methyl-propanenitrile
Cas Number: 1393100-52-1Formula: C8H12N4Molecular weight: 164.21Synonyms: 2-(4-amino-3-methyl-pyrazol-1-yl)-2-methyl-propanenitrile | 1393100-52-1 | SCHEMBL17076907 | MFCD316...SMILES: CC1=NN(C=C1N)C(C)(C)C#NInChIKey: BFALMXAGRXTAGV-UHFFFAOYSA-NInChI: InChI=1S/C8H12N4/c1-6-7(10)4-12(11-6)8(2,3)5-9/h4H,10H2,1-3H3
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acetic acid;tert-butyl azetidine-3-carboxylate
Cas Number: 1236144-52-7Formula: C8H15NO2·C2H4O2Molecular weight: 217.26Synonyms: tert-Butyl azetidine-3-carboxylate acetate | 1236144-52-7 | TERT-BUTYL AZETIDINE-3-CARBOXYLATE HOAC ...SMILES: CC(=O)O.CC(C)(C)OC(=O)C1CNC1InChIKey: ZAYKPGRYPKUMLW-UHFFFAOYSA-NInChI: InChI=1S/C8H15NO2.C2H4O2/c1-8(2,3)11-7(10)6-4-9-5-6;1-2(3)4/h6,9H,4-5H2,1-3H3;1H3,(H,3,4)
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