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Search results for: '67874-71-9'
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tert-butyl cis-3,6-dihydroxyazepane-1-carboxylate
Cas Number: 1801455-71-9Formula: C11H21NO4Molecular weight: 231.29Synonyms: tert-butyl cis-3,6-dihydroxyazepane-1-carboxylate | 1801455-71-9 | Rel-tert-butyl (3R,6S)-3,6-dihydr...SMILES: CC(C)(C)OC(=O)N1CC(CCC(C1)O)OInChIKey: HIOZHPDILDLJAS-DTORHVGOSA-NInChI: InChI=1S/C11H21NO4/c1-11(2,3)16-10(15)12-6-8(13)4-5-9(14)7-12/h8-9,13-14H,4-7H2,1-3H3/t8-,9+
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Fmoc-D-3-nitrophenylalanine
Cas Number: 478183-71-0Formula: C24H20N2O6Molecular weight: 432.4Synonyms: 478183-71-0|Fmoc-3-nitro-D-phenylalanine|FMOC-D-3-NITROPHENYLALANINE|(R)-2-((((9H-Fluoren-9-yl)metho...SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC(=CC=C4)[N+](=O)[O-])C(=O)OInChIKey: UDIZJKKIJYRJIN-JOCHJYFZSA-NInChI: InChI=1S/C24H20N2O6/c27-23(28)22(13-15-6-5-7-16(12-15)26(30)31)25-24(29)32-14-21-19-10-3-1-8-17(19)18-9-2-4-11-20(18)21/h1-12,21-22H,13-14H2,(H,25,29)(H,27,28)/t22-/m1/s1
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2,4-DIMETHYL-3-HEPTANONE
Cas Number: 18641-71-9Formula: C9H18OMolecular weight: 142.243Synonyms: 2,4-dimethylheptan-3-one|2,4-DIMETHYL-3-HEPTANONE|18641-71-9|3-Heptanone, 2,4-dimethyl-|3-Heptanone,...SMILES: CCCC(C)C(=O)C(C)CInChIKey: MMEXTUAHJZOQKN-UHFFFAOYSA-NInChI: InChI=1S/C9H18O/c1-5-6-8(4)9(10)7(2)3/h7-8H,5-6H2,1-4H3
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4-Bromo-6-fluorobenzene-1,3-diamine
Cas Number: 166818-71-9Formula: C6H6BrFN2Molecular weight: 205Synonyms: 4-Bromo-6-fluorobenzene-1,3-diamine|166818-71-9|2-Bromo-4-fluorobenzene-1,5-diamine|SCHEMBL6659815|D...SMILES: C1=C(C(=CC(=C1N)Br)F)NInChIKey: ARZWRJIHIDYIGS-UHFFFAOYSA-NInChI: InChI=1S/C6H6BrFN2/c7-3-1-4(8)6(10)2-5(3)9/h1-2H,9-10H2
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3-Ethoxy-5-methylphenylboronic acid, pinacol ester
Cas Number: 1218789-71-9Formula: C15H23BO3Molecular weight: 262.2Synonyms: 1218789-71-9|2-(3-Ethoxy-5-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|3-Ethoxy-5-methylph...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)OCC)CInChIKey: VBCLFQLYUBDJKX-UHFFFAOYSA-NInChI: InChI=1S/C15H23BO3/c1-7-17-13-9-11(2)8-12(10-13)16-18-14(3,4)15(5,6)19-16/h8-10H,7H2,1-6H3
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Cephalothin sodium salt
Cas Number: 58-71-9Formula: C16H15N2NaO6S2Molecular weight: 418.42Synonyms: CEPHALOTHIN SODIUM|58-71-9|cefalotin sodium|Sodium cephalothin|Cephalothin sodium salt|Sodium cefalo...SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)[O-].[Na+]InChIKey: VUFGUVLLDPOSBC-XRZFDKQNSA-MInChI: InChI=1S/C16H16N2O6S2.Na/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10;/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23);/q;+1/p-1/t12-,15-;/m1./s1
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5-Methyl-2-(trifluoromethyl)pyridine
Cas Number: 1620-71-9Formula: C7H6F3NMolecular weight: 161.12Synonyms: 5-Methyl-2-(trifluoromethyl)pyridine|1620-71-9|Pyridine, 5-methyl-2-(trifluoromethyl)-|5-METHYL-2-TR...SMILES: CC1=CN=C(C=C1)C(F)(F)FInChIKey: HALCBPJUGWBVBU-UHFFFAOYSA-NInChI: InChI=1S/C7H6F3N/c1-5-2-3-6(11-4-5)7(8,9)10/h2-4H,1H3
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Poly(3-decylthiophene-2,5-diyl)
Cas Number: 110851-65-5Formula: C10H13NMolecular weight: 147.22Synonyms: 4-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINE|110841-71-9|4-Methyl-1,2,3,4-tetrahydro-isoquinoline|110851-...SMILES: CC1CNCC2=CC=CC=C12InChIKey: TWIPIAJYKZMIPL-UHFFFAOYSA-NInChI: InChI=1S/C10H13N/c1-8-6-11-7-9-4-2-3-5-10(8)9/h2-5,8,11H,6-7H2,1H3
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α-Chlordane Standard
Formula: C10H6Cl8Molecular weight: 409.78Synonyms: cis-Chlordane|5103-71-9|(+)cis-chlordane|ALPHA-CHLORDANE|DTXSID6038326|cis-Chlordane 10 microg/mL in...SMILES: C1C2C(C(C1Cl)Cl)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)ClInChIKey: BIWJNBZANLAXMG-KMMBHOGFSA-NInChI: InChI=1S/C10H6Cl8/c11-3-1-2-4(5(3)12)9(16)7(14)6(13)8(2,15)10(9,17)18/h2-5H,1H2/t2-,3-,4-,5-,8-,9+/m0/s1
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1-methyl-1H-pyrazole-4-carbonitrile
Cas Number: 66121-71-9Formula: C5H5N3Molecular weight: 107.11Synonyms: 1-methyl-1H-pyrazole-4-carbonitrile|66121-71-9|4-Cyano-1-methylpyrazole|1-methylpyrazole-4-carbonitr...SMILES: CN1C=C(C=N1)C#NInChIKey: NIBQNKBEGIMBSV-UHFFFAOYSA-NInChI: InChI=1S/C5H5N3/c1-8-4-5(2-6)3-7-8/h3-4H,1H3
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4-Bromo-2-methylphenylboronic acid (contains varying amounts of Anhydride)
Cas Number: 221006-71-9Formula: C7H8BBrO2Molecular weight: 214.9Synonyms: 221006-71-9|4-BROMO-2-METHYLPHENYLBORONIC ACID|(4-Bromo-2-methylphenyl)boronic acid|4-Bromo-2-methyl...SMILES: B(C1=C(C=C(C=C1)Br)C)(O)OInChIKey: BEQUDVVISBTSHZ-UHFFFAOYSA-NInChI: InChI=1S/C7H8BBrO2/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,10-11H,1H3
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4-Chloro-3-(trifluoromethyl)benzyl alcohol
Cas Number: 65735-71-9Formula: C8H6ClF3OMolecular weight: 210.58Synonyms: 65735-71-9|4-Chloro-3-(trifluoromethyl)benzyl alcohol|(4-Chloro-3-(trifluoromethyl)phenyl)methanol|[...SMILES: C1=CC(=C(C=C1CO)C(F)(F)F)ClInChIKey: JRYCPYROZOWIDJ-UHFFFAOYSA-NInChI: InChI=1S/C8H6ClF3O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-3,13H,4H2
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Polygalacic acid
Cas Number: 22338-71-2(DMSO)Formula: C30H48O6Molecular weight: 504.7Synonyms: 22338-71-2|Virgaureagenin G|(4aR,5R,6aR,6aS,6bR,9R,10R,11S,12aR,14bR)-5,10,11-trihydroxy-9-(hydroxym...SMILES: CC1(CCC2(C(C1)C3=CCC4C(C3(CC2O)C)(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C(=O)O)CInChIKey: KGGGRGBDMBZXKF-KZMOAHQXSA-NInChI: See more
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2-Isopropoxy-5-methylphenylboronic acid
Cas Number: 480438-71-9Formula: C10H15BO3Molecular weight: 194.04Synonyms: 2-Isopropoxy-5-methylphenylboronic acid|480438-71-9|(5-methyl-2-propan-2-yloxyphenyl)boronic acid|(2...SMILES: B(C1=C(C=CC(=C1)C)OC(C)C)(O)OInChIKey: PESPTYNENYUZTH-UHFFFAOYSA-NInChI: InChI=1S/C10H15BO3/c1-7(2)14-10-5-4-8(3)6-9(10)11(12)13/h4-7,12-13H,1-3H3
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2-Chloro-5-hydroxyphenylboronic acid
Cas Number: 913835-71-9Formula: C6H6BClO3Molecular weight: 172.4Synonyms: 913835-71-9|(2-Chloro-5-hydroxyphenyl)boronic acid|2-Chloro-5-hydroxyphenylboronic acid|2-Chloro-5-h...SMILES: B(C1=C(C=CC(=C1)O)Cl)(O)OInChIKey: SLAPQAZQRNMJLC-UHFFFAOYSA-NInChI: InChI=1S/C6H6BClO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9-11H
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Bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate
Cas Number: 84-71-9Formula: C24H44O4Molecular weight: 396.6Synonyms: Bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate|84-71-9|1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-...SMILES: CCCCC(CC)COC(=O)C1CCCCC1C(=O)OCC(CC)CCCCInChIKey: DIMOQAGSNHTROK-UHFFFAOYSA-NInChI: InChI=1S/C24H44O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h19-22H,5-18H2,1-4H3
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4-Benzyloxyindole-3-carboxaldehyde
Cas Number: 7042-71-9Formula: C16H13NO2Molecular weight: 251.28Synonyms: 7042-71-9|4-Benzyloxyindole-3-carboxaldehyde|4-BENZYLOXYINDOLE-3-CARBALDEHYDE|4-(benzyloxy)-1H-indol...SMILES: C1=CC=C(C=C1)COC2=CC=CC3=C2C(=CN3)C=OInChIKey: WURDDLFAUSUSLT-UHFFFAOYSA-NInChI: InChI=1S/C16H13NO2/c18-10-13-9-17-14-7-4-8-15(16(13)14)19-11-12-5-2-1-3-6-12/h1-10,17H,11H2
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2,4-dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine
Cas Number: 1192711-71-9Formula: C7H5Cl2N3Molecular weight: 202.04Synonyms: 2,4-Dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine|1192711-71-9|MFCD13193622|7H-PYRROLO[2,3-D]PYRIMID...SMILES: CC1=CC2=C(N1)N=C(N=C2Cl)ClInChIKey: QOEYSTWXKJBVQE-UHFFFAOYSA-NInChI: InChI=1S/C7H5Cl2N3/c1-3-2-4-5(8)11-7(9)12-6(4)10-3/h2H,1H3,(H,10,11,12)
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(3-Bromo-6-chloropyridin-2-yl)methanol
Cas Number: 1227601-71-9Formula: C6H5NOClBrMolecular weight: 222.46Synonyms: (3-BROMO-6-CHLOROPYRIDIN-2-YL)METHANOL|1227601-71-9|3-Bromo-6-chloropyridine-2-methanol|MFCD11847140...SMILES: C1=CC(=NC(=C1Br)CO)ClInChIKey: HOVCGEVZLGMGSK-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrClNO/c7-4-1-2-6(8)9-5(4)3-10/h1-2,10H,3H2
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1-methyl-octahydro-1H-pyrrolo[3,2-c]pyridine dihydrochloride
Cas Number: 172281-71-9Synonyms: 172281-71-9 | 1-methyl-octahydro-1H-pyrrolo[3,2-c]pyridine dihydrochloride | 1-Methyloctahydro-1H-py...SMILES: CN1CCC2C1CCNC2.Cl.ClInChIKey: AAZUALOIURDYTG-UHFFFAOYSA-NInChI: InChI=1S/C8H16N2.2ClH/c1-10-5-3-7-6-9-4-2-8(7)10;;/h7-9H,2-6H2,1H3;2*1H
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2-(Hydroxymethyl)pyridine-5-boronic acid, pinacol ester
Cas Number: 1078575-71-9Formula: C12H18BNO3Molecular weight: 235.1Synonyms: 1078575-71-9|(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)METHANOL|[5-(4,4,5,5-tetra...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)COInChIKey: XFCRCZYNRQHVDP-UHFFFAOYSA-NInChI: InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-5-6-10(8-15)14-7-9/h5-7,15H,8H2,1-4H3
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2-(4-Methoxyphenyl)benzoic acid
Cas Number: 18110-71-9Formula: C14H12O3Molecular weight: 228.2Synonyms: 18110-71-9|2-(4-Methoxyphenyl)benzoic acid|4'-Methoxy-[1,1'-biphenyl]-2-carboxylic acid|4'-methoxy[1...SMILES: COC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OInChIKey: IPLPMLYQQDEHHD-UHFFFAOYSA-NInChI: InChI=1S/C14H12O3/c1-17-11-8-6-10(7-9-11)12-4-2-3-5-13(12)14(15)16/h2-9H,1H3,(H,15,16)
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(3R)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid
Cas Number: 1260609-71-9Formula: C10H10O3Molecular weight: 178.19Synonyms: (R)-CHROMAN-3-CARBOXYLIC ACID | 1260609-71-9 | (3R)-3,4-dihydro-2H-chromene-3-carboxylic acid | (3R)...SMILES: C1C(COC2=CC=CC=C21)C(=O)OInChIKey: UGAGZMGJJFSKQM-MRVPVSSYSA-NInChI: InChI=1S/C10H10O3/c11-10(12)8-5-7-3-1-2-4-9(7)13-6-8/h1-4,8H,5-6H2,(H,11,12)/t8-/m1/s1
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Levofloxacin-d8
Cas Number: 1217716-71-6Formula: C18H12D8FN3O4Molecular weight: 369.42Synonyms: (-)-(S)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl-d8)-7-oxo-7H-pyrido[1,2,3-de]-1,4-b...SMILES: CC1COC2=C3N1C=C(C(=O)C3=CC(=C2N4CCN(CC4)C)F)C(=O)OInChIKey: GSDSWSVVBLHKDQ-FMBBTWBHSA-NInChI: InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1/i3D2,4D2,5D2,6D2
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