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Search results for: '1985-46-2'
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4-Amino-6-iodo-2-methylpyrimidine
Cas Number: 943006-46-0Formula: C5H6IN3Molecular weight: 235Synonyms: 4-Amino-6-iodo-2-methylpyrimidine|943006-46-0|6-Iodo-2-methylpyrimidin-4-amine|SCHEMBL2528347|DTXSID...SMILES: CC1=NC(=CC(=N1)I)NInChIKey: GZHINVBVMNLSCG-UHFFFAOYSA-NInChI: InChI=1S/C5H6IN3/c1-3-8-4(6)2-5(7)9-3/h2H,1H3,(H2,7,8,9)
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3-Acetoxy-2-methylbenzoyl chloride
Cas Number: 167678-46-8Formula: C10H9ClO3Molecular weight: 212.63Synonyms: 3-Acetoxy-2-methylbenzoyl Chloride|167678-46-8|3-(Chlorocarbonyl)-2-methylphenyl Acetate|(3-carbonoc...SMILES: CC1=C(C=CC=C1OC(=O)C)C(=O)ClInChIKey: COLDUSGLGQXXEJ-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClO3/c1-6-8(10(11)13)4-3-5-9(6)14-7(2)12/h3-5H,1-2H3
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N-palmitoyl L-serine
Cas Number: 58725-46-5Formula: C19H36NNaO4Molecular weight: 365.483Synonyms: Sodium N-palmitoyl-L-serinate|58725-46-5|EINECS 261-408-4|sodium;(2S)-2-(hexadecanoylamino)-3-hydrox...SMILES: CCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)[O-].[Na+]InChIKey: XKMKJRANXQGSEK-LMOVPXPDSA-MInChI: InChI=1S/C19H37NO4.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(22)20-17(16-21)19(23)24;/h17,21H,2-16H2,1H3,(H,20,22)(H,23,24);/q;+1/p-1/t17-;/m0./s1
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2-Acetylcyclopentanone
Formula: C7H10O2Molecular weight: 126.15Synonyms: 2-Acetylcyclopentanone|1670-46-8|2-Acetylcyclopentan-1-one|Cyclopentanone, 2-acetyl-|alpha-Acetylcyc...SMILES: CC(=O)C1CCCC1=OInChIKey: OSWDNIFICGLKEE-UHFFFAOYSA-NInChI: InChI=1S/C7H10O2/c1-5(8)6-3-2-4-7(6)9/h6H,2-4H2,1H3
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Ethyl 2-(trifluoromethyl)thiazole-4-carboxylate
Cas Number: 133046-46-5Formula: C7H6F3NO2SMolecular weight: 225.19Synonyms: Ethyl 2-(trifluoromethyl)thiazole-4-carboxylate|133046-46-5|ethyl 2-(trifluoromethyl)-1,3-thiazole-4...SMILES: CCOC(=O)C1=CSC(=N1)C(F)(F)FInChIKey: WFUNYBAJYAWHLX-UHFFFAOYSA-NInChI: InChI=1S/C7H6F3NO2S/c1-2-13-5(12)4-3-14-6(11-4)7(8,9)10/h3H,2H2,1H3
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5-bromospiro[1,2-dihydropyrrolo[2,3-b]pyridine-3,1'-cyclopropane]
Cas Number: 2168819-46-1Formula: C9H9N2BrMolecular weight: 225.08Synonyms: 2168819-46-1 | 5'-bromo-1',2'-dihydrospiro[cyclopropane-1,3'-pyrrolo[2,3-b]pyridine] | 5-bromospiro[...SMILES: C1CC12CNC3=C2C=C(C=N3)BrInChIKey: ZDBQKBAMZLXWBY-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrN2/c10-6-3-7-8(11-4-6)12-5-9(7)1-2-9/h3-4H,1-2,5H2,(H,11,12)
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tert-butyl N-[(1S)-2-oxocyclopentyl]carbamate
Cas Number: 145106-46-3Formula: C10H17NO3Molecular weight: 199.25Synonyms: 145106-46-3 | tert-Butyl N-[(1S)-2-oxocyclopentyl]carbamate | (S)-tert-Butyl (2-oxocyclopentyl)carba...SMILES: CC(C)(C)OC(=O)NC1CCCC1=OInChIKey: UXSQXOIYRVCHBS-ZETCQYMHSA-NInChI: InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(7)12/h7H,4-6H2,1-3H3,(H,11,13)/t7-/m0/s1
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(S)-2-(tert-Butoxycarbonyl)isoxazolidine-3-carboxylic Acid
Cas Number: 1372202-46-4Formula: C9H15NO5Molecular weight: 217.22Synonyms: HY-W141882 | (S)-N-BOC-ISOXAZOLIDINE-3-CARBOXYLIC ACID | 1372202-46-4 | SCHEMBL8344500 | (3S)-2-tert...SMILES: CC(C)(C)OC(=O)N1C(CCO1)C(=O)OInChIKey: FQNQHKBAZFREIU-LURJTMIESA-NInChI: InChI=1S/C9H15NO5/c1-9(2,3)15-8(13)10-6(7(11)12)4-5-14-10/h6H,4-5H2,1-3H3,(H,11,12)/t6-/m0/s1
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4-(N-Ethylsulfamoyl)-2-methylphenylboronic acid
Cas Number: 1217501-46-6Formula: C9H14BNO4SMolecular weight: 243.1Synonyms: 1217501-46-6|(4-(N-Ethylsulfamoyl)-2-methylphenyl)boronic acid|4-(N-Ethylsulfamoyl)-2-methylphenylbo...SMILES: B(C1=C(C=C(C=C1)S(=O)(=O)NCC)C)(O)OInChIKey: QIEIERVEUKRVNM-UHFFFAOYSA-NInChI: InChI=1S/C9H14BNO4S/c1-3-11-16(14,15)8-4-5-9(10(12)13)7(2)6-8/h4-6,11-13H,3H2,1-2H3
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2,6-Dihydroxybenzaldehyde
Cas Number: 387-46-2Formula: C7H6O3Molecular weight: 138.12Synonyms: 2,6-dihydroxybenzaldehyde|387-46-2|Benzaldehyde, 2,6-dihydroxy-|Ranjal|resorcinol-formaldehyde|6-Hyd...SMILES: C1=CC(=C(C(=C1)O)C=O)OInChIKey: DGXAGETVRDOQFP-UHFFFAOYSA-NInChI: InChI=1S/C7H6O3/c8-4-5-6(9)2-1-3-7(5)10/h1-4,9-10H
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7-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)quinazoline
Cas Number: 1375108-46-5Formula: C14H17BN2O2Molecular weight: 256.11Synonyms: DTXSID60739783 | AS-55542 | MFCD18205965 | 7-(tetramethyl-1,3,2-dioxaborolan-2-yl)quinazoline | RJXJ...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=NC=NC=C3C=C2InChIKey: RJXJTNJULNSBLM-UHFFFAOYSA-NInChI: InChI=1S/C14H17BN2O2/c1-13(2)14(3,4)19-15(18-13)11-6-5-10-8-16-9-17-12(10)7-11/h5-9H,1-4H3
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4-bromopyridine-2-carboxamide
Cas Number: 62150-46-3Formula: C6H5BrN2OMolecular weight: 201.023Synonyms: 4-Bromopicolinamide|62150-46-3|4-bromo-2-pyridinecarboxamide|4-bromopyridine-2-carboxamide|4-Bromo-p...SMILES: C1=CN=C(C=C1Br)C(=O)NInChIKey: HOKMIQUAXGAICH-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrN2O/c7-4-1-2-9-5(3-4)6(8)10/h1-3H,(H2,8,10)
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6-Chloro-2-fluoronicotinic acid
Cas Number: 1211578-46-9 EC Number: 842-116-1Formula: C6H3ClFNO2Molecular weight: 175.54Synonyms: DTXSID00855835 | A891882 | RB3340 | 6-Chloro-2-fluoronicotinic acid | 6-Chloro-2-fluoronicotinicacid...SMILES: C1=CC(=NC(=C1C(=O)O)F)ClInChIKey: GSSVAHBRTISODE-UHFFFAOYSA-NInChI: InChI=1S/C6H3ClFNO2/c7-4-2-1-3(6(10)11)5(8)9-4/h1-2H,(H,10,11)
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Methyl 2-bromo-6-methoxybenzoate
Cas Number: 31786-46-6Formula: C9H9BrO3Molecular weight: 245.1Synonyms: METHYL 2-BROMO-6-METHOXYBENZOATE|31786-46-6|MFCD14697992|Methyl2-bromo-6-methoxybenzoate|Benzoic aci...SMILES: COC1=C(C(=CC=C1)Br)C(=O)OCInChIKey: LPZDOTAGNAUWRS-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrO3/c1-12-7-5-3-4-6(10)8(7)9(11)13-2/h3-5H,1-2H3
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(1-methylpyrazol-3-yl)methylhydrazine;dihydrochloride
Cas Number: 2231673-46-2Synonyms: 2231673-46-2 | (1-methylpyrazol-3-yl)methylhydrazine | dihydrochloride | (1-methylpyrazol-3-yl)methy...SMILES: CN1C=CC(=N1)CNN.Cl.ClInChIKey: QOCQLWVTLBVMBR-UHFFFAOYSA-NInChI: InChI=1S/C5H10N4.2ClH/c1-9-3-2-5(8-9)4-7-6;;/h2-3,7H,4,6H2,1H3;2*1H
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Ethyl Isocyanoacetate
Cas Number: 2999-46-4Formula: C5H7NO2Molecular weight: 113.12Synonyms: Ethyl isocyanoacetate|2999-46-4|ethyl 2-isocyanoacetate|Isocyanoacetic Acid Ethyl Ester|ETHYLISOCYAN...SMILES: CCOC(=O)C[N+]#[C-]InChIKey: FPULFENIJDPZBX-UHFFFAOYSA-NInChI: InChI=1S/C5H7NO2/c1-3-8-5(7)4-6-2/h3-4H2,1H3
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2-Chloro-5-methoxyphenylboronic acid
Cas Number: 89694-46-2Formula: C7H8BClO3Molecular weight: 186.4Synonyms: 2-chloro-5-methoxyphenylboronic acid|89694-46-2|(2-Chloro-5-methoxyphenyl)boronic acid|2-Chloro-5-me...SMILES: B(C1=C(C=CC(=C1)OC)Cl)(O)OInChIKey: REFXAANPQCJZRY-UHFFFAOYSA-NInChI: InChI=1S/C7H8BClO3/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,10-11H,1H3
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5-Bromo-4-phenylpyrimidine
Cas Number: 3543-46-2Formula: C10H7BrN2Molecular weight: 235.1Synonyms: 5-bromo-4-phenylpyrimidine|3543-46-2|5-bromo-4-phenyl-pyrimidine|SCHEMBL11856101|DTXSID30355797|SDPY...SMILES: C1=CC=C(C=C1)C2=NC=NC=C2BrInChIKey: SDPYFZLDWYNXJF-UHFFFAOYSA-NInChI: InChI=1S/C10H7BrN2/c11-9-6-12-7-13-10(9)8-4-2-1-3-5-8/h1-7H
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4-(Pentyloxy)picolinimidamide hydrochloride
Cas Number: 1179362-46-9Formula: C11H18ClN3OMolecular weight: 243.73Synonyms: 4-(pentyloxy)picolinimidamide hydrochloride|1179362-46-9|4-pentoxypyridine-2-carboximidamide;hydroch...SMILES: CCCCCOC1=CC(=NC=C1)C(=N)N.ClInChIKey: CFURGSGVMJPTQF-UHFFFAOYSA-NInChI: InChI=1S/C11H17N3O.ClH/c1-2-3-4-7-15-9-5-6-14-10(8-9)11(12)13;/h5-6,8H,2-4,7H2,1H3,(H3,12,13);1H
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4-Bromoquinoline-2-carboxylic acid
Cas Number: 209003-46-3Formula: C10H6BrNO2Molecular weight: 252.06Synonyms: 4-bromoquinoline-2-carboxylic acid|209003-46-3|2-Quinolinecarboxylic acid, 4-bromo-|MFCD08705670|SCH...SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C(=O)O)BrInChIKey: DLAHQKXVDUYPHR-UHFFFAOYSA-NInChI: InChI=1S/C10H6BrNO2/c11-7-5-9(10(13)14)12-8-4-2-1-3-6(7)8/h1-5H,(H,13,14)
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1,2-Di(pyrimidin-2-yl)disulfane
Cas Number: 15718-46-4Formula: C8H6N4S2Molecular weight: 222.29Synonyms: 15718-46-4|Bis(2-pyrimidyl) disulfide|1,2-di(pyrimidin-2-yl)disulfane|2-(pyrimidin-2-yldisulfanyl)py...SMILES: C1=CN=C(N=C1)SSC2=NC=CC=N2InChIKey: LJINHMVNIBCANU-UHFFFAOYSA-NInChI: InChI=1S/C8H6N4S2/c1-3-9-7(10-4-1)13-14-8-11-5-2-6-12-8/h1-6H
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Sulbutiamine
Cas Number: 3286-46-2Formula: C32H46N8O6S2Molecular weight: 702.89Synonyms: NCGC00167456-02 | AKOS015965079 | NCGC00167456-01 | CCG-270389 | SCHEMBL25578 | Tox21_112460 | CAS-3...SMILES: CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOC(=O)C(C)C)SSC(=C(C)N(CC2=CN=C(N=C2N)C)C=O)CCOC(=O)C(C)C)CInChIKey: CKHJPWQVLKHBIH-ZDSKVHJSSA-NInChI: See more
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5-bromo-1-methyl-1H-pyrazolo[3,4-c]pyridine
Cas Number: 1337880-46-2Formula: C7H6BrN3Molecular weight: 212.05Synonyms: 5-Bromo-1-methyl-1H-pyrazolo[3,4-c]pyridine | 1337880-46-2 | 5-bromo-1-methylpyrazolo[3,4-c]pyridine...SMILES: CN1C2=CN=C(C=C2C=N1)BrInChIKey: ZHFVKDMZVPFKDG-UHFFFAOYSA-NInChI: InChI=1S/C7H6BrN3/c1-11-6-4-9-7(8)2-5(6)3-10-11/h2-4H,1H3
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methyl 5-fluoro-6-methyl-pyrimidine-4-carboxylate
Cas Number: 916213-46-2Formula: C7H7N2O2FMolecular weight: 170.14Synonyms: methyl 5-fluoro-6-methylpyrimidine-4-carboxylate | 916213-46-2 | SCHEMBL8201600 | SB56703 | CS-03095...SMILES: CC1=C(C(=NC=N1)C(=O)OC)FInChIKey: LTWSHFQIAADBNH-UHFFFAOYSA-NInChI: InChI=1S/C7H7FN2O2/c1-4-5(8)6(7(11)12-2)10-3-9-4/h3H,1-2H3
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