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Search results for: '249-649-3'
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Malonic acid dihydrazide
Cas Number: 3815-86-9Formula: C3H8N4O2Molecular weight: 132.123Synonyms: PSIKPHJLTVSQFO-UHFFFAOYSA- | NSC 649 | BRN 1072337 | SB85904 | 1,1':2',1''-Terphenyl, 3',4',5',6'-te...SMILES: C(C(=O)NN)C(=O)NNInChIKey: PSIKPHJLTVSQFO-UHFFFAOYSA-NInChI: InChI=1S/C3H8N4O2/c4-6-2(8)1-3(9)7-5/h1,4-5H2,(H,6,8)(H,7,9)
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3,3,4,4-Tetrachlorosulfolane
Cas Number: 3737-41-5Formula: C4H4Cl4O2SMolecular weight: 257.93Synonyms: DAC 649 | Q27289245 | 3,3,4,4-tetrachloro-sulpholane | T72383 | InChI=1/C4H4Cl4O2S/c5-3(6)1-11(9,10)...SMILES: C1C(C(CS1(=O)=O)(Cl)Cl)(Cl)ClInChIKey: GCAXGCSCRRVVLF-UHFFFAOYSA-NInChI: InChI=1S/C4H4Cl4O2S/c5-3(6)1-11(9,10)2-4(3,7)8/h1-2H2
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laevulinic acid
Formula: C5H8O3Molecular weight: 116.12Synonyms: Z104477318 | Laevulinic acid | NCGC00259034-01 | 4-ketovalerate | DTXCID701648 | EINECS 204-649-2 | ...SMILES: CC(=O)CCC(=O)OInChIKey: JOOXCMJARBKPKM-UHFFFAOYSA-NInChI: InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
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5-Chloro-2-nitrophenol
Cas Number: 611-07-4Formula: C6H4ClNO3Molecular weight: 173.6Synonyms: 5-CHLORO-2-NITROPHENOL|611-07-4|Phenol, 5-chloro-2-nitro-|2-nitro-5-chlorophenol|6-Nitro-3-chlorophe...SMILES: C1=CC(=C(C=C1Cl)O)[N+](=O)[O-]InChIKey: MZDBQSFPAMTTIS-UHFFFAOYSA-NInChI: InChI=1S/C6H4ClNO3/c7-4-1-2-5(8(10)11)6(9)3-4/h1-3,9H
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Cashmeran
Cas Number: 33704-61-9Formula: C14H22OMolecular weight: 206.32Synonyms: 6,7-Dihydro-1,1,2,3,3-pentamethyl-4-(5H)indanone | 6,7-Dihydro-1,1,2,3,3-pentamethyl-4(5H)-indanone ...SMILES: CC1C(C2=C(C1(C)C)C(=O)CCC2)(C)CInChIKey: MIZGSAALSYARKU-UHFFFAOYSA-NInChI: InChI=1S/C14H22O/c1-9-13(2,3)10-7-6-8-11(15)12(10)14(9,4)5/h9H,6-8H2,1-5H3
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tert-Tetradecanethiol (mixture of isomers)
Cas Number: 28983-37-1Formula: C14H30SMolecular weight: 230.45Synonyms: t-tetradecanethiol | T0083 | EINECS 249-351-3 | 2-methyltridecane-2-thiol | tert-Tetradecyl mercapta...SMILES: CCCCCCCCCCCC(C)(C)SInChIKey: LMDDHLWHSDZGIH-UHFFFAOYSA-NInChI: InChI=1S/C14H30S/c1-4-5-6-7-8-9-10-11-12-13-14(2,3)15/h15H,4-13H2,1-3H3
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1-Benzylpyrrolidine
Cas Number: 29897-82-3Formula: C11H15NMolecular weight: 161.24Synonyms: 1-Benzylpyrrolidine|29897-82-3|N-Benzylpyrrolidine|1-BENZYL-PYRROLIDINE|Pyrrolidine, 1-(phenylmethyl...SMILES: C1CCN(C1)CC2=CC=CC=C2InChIKey: CWEGCQIIDCZZED-UHFFFAOYSA-NInChI: InChI=1S/C11H15N/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h1-3,6-7H,4-5,8-10H2
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Isolongifolone
Cas Number: 23787-90-8 EC Number: 249-649-3SMILES: CC1(CCC(=O)C2C13CCC(C3)C2(C)C)CInChIKey: VCOCESNMLNDPLX-UHFFFAOYSA-NInChI: InChI=1S/C15H24O/c1-13(2)7-6-11(16)12-14(3,4)10-5-8-15(12,13)9-10/h10,12H,5-9H2,1-4H3
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3-Chloro-4-methoxyphenyl isocyanate
Cas Number: 28395-76-8Formula: C8H6ClNO2Molecular weight: 183.6Synonyms: BS-22880 | 2-Chloro-4-isocyanatoanisole | EN300-147122 | A819435 | DTXSID70182620 | 2-chloro-4-isocy...SMILES: COC1=C(C=C(C=C1)N=C=O)ClInChIKey: XYRDQHNCDBDNSF-UHFFFAOYSA-NInChI: InChI=1S/C8H6ClNO2/c1-12-8-3-2-6(10-5-11)4-7(8)9/h2-4H,1H3
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4,5-Dimethyl-3-hydroxy-2,5-dihydrofuran-2-one
Cas Number: 28664-35-9 EC Number: 249-136-4Formula: C6H8O3Molecular weight: 128.13Synonyms: 4,5-Dimethyl-3-hydroxy-2(5H)-furanone | FT-0617204 | NCGC00256815-01 | SCHEMBL246671 | Q421173 | CAS...SMILES: CC1C(=C(C(=O)O1)O)CInChIKey: UNYNVICDCJHOPO-UHFFFAOYSA-NInChI: InChI=1S/C6H8O3/c1-3-4(2)9-6(8)5(3)7/h4,7H,1-2H3
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3-Amino-4-chlorobenzenesulfonamide
Cas Number: 29092-34-0Formula: C6H7ClN2O2SMolecular weight: 206.65Synonyms: 3-amino-4-chlorobenzenesulfonamide | 3-Amino-4-chloro-benzenesulfonamide | CCG-105189 | Benzenesulfo...SMILES: C1=CC(=C(C=C1S(=O)(=O)N)N)ClInChIKey: OIWCPLBCWJUCMR-UHFFFAOYSA-NInChI: InChI=1S/C6H7ClN2O2S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3H,8H2,(H2,9,10,11)
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1-Isopropylnaphthalene
Cas Number: 6158-45-8Formula: C13H14Molecular weight: 170.26Synonyms: Naphthalene, (1-methylethyl)- | alpha-Isopropylnaphthalene | EC 249-535-3 | 1-propan-2-ylnaphthalene...SMILES: CC(C)C1=CC=CC2=CC=CC=C21InChIKey: PMPBFICDXLLSRM-UHFFFAOYSA-NInChI: InChI=1S/C13H14/c1-10(2)12-9-5-7-11-6-3-4-8-13(11)12/h3-10H,1-2H3
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4-Chlorocinnamonitrile, mixture of cis and trans
Cas Number: 28446-72-2Formula: ClC6H4CH=CHCNMolecular weight: 163.6Synonyms: J-017077 | (E)-3-(4-chlorophenyl)prop-2-enenitrile | EN300-25512 | NSC636944 | 2-Propenenitrile, 3-(...SMILES: C1=CC(=CC=C1C=CC#N)ClInChIKey: PPCNBCKABHGVMX-OWOJBTEDSA-NInChI: InChI=1S/C9H6ClN/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6H/b2-1+
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5H-Pyrido[4,3-b]indole
Cas Number: 244-69-9Formula: C11H8N2Molecular weight: 168.2Synonyms: SCHEMBL4127392 | 3-azacarbazole | NSC 160470 | NSC 758696 | BDBM50572080 | 5H-Pyrido(4,3-b)indole | ...SMILES: C1=CC=C2C(=C1)C3=C(N2)C=CN=C3InChIKey: RDMFHRSPDKWERA-UHFFFAOYSA-NInChI: InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-7,13H
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Nepafenac, Cyclooxygenase inhibitor
Cas Number: 78281-72-8Formula: C15H14N2O2Molecular weight: 254.28Synonyms: 2-[2-amino-3-(benzoyl)phenyl]acetamide | DB06802 | Nevanac | S01BC10 | 3-Pyridinecarboxylic acid,2,5...SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC(=C2N)CC(=O)NInChIKey: QEFAQIPZVLVERP-UHFFFAOYSA-NInChI: InChI=1S/C15H14N2O2/c16-13(18)9-11-7-4-8-12(14(11)17)15(19)10-5-2-1-3-6-10/h1-8H,9,17H2,(H2,16,18)
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3-Chloro-4-methylphenyl Isocyanate
Cas Number: 28479-22-3 EC Number: 249-050-7Formula: C8H6ClNOMolecular weight: 167.59Synonyms: 3-Chloro-4-methylphenyl isocyanate [UN2236] [Poison] | UN2236 | 3-chlor-4-methylphenylisocyanat | P...SMILES: CC1=C(C=C(C=C1)N=C=O)ClInChIKey: UKTKKMZDESVUEE-UHFFFAOYSA-NInChI: InChI=1S/C8H6ClNO/c1-6-2-3-7(10-5-11)4-8(6)9/h2-4H,1H3
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2-Methylcyclopropanecarboxylic acid(cis- and trans- mixture)
Cas Number: 29555-02-0Formula: CH3C3H4CO2HMolecular weight: 100.12Synonyms: 2-Methylcyclopropanecarboxylic acid|29555-02-0|2-methylcyclopropane-1-carboxylic acid|Cyclopropaneca...SMILES: CC1CC1C(=O)OInChIKey: AYEGPMGNMOIHDL-UHFFFAOYSA-NInChI: InChI=1S/C5H8O2/c1-3-2-4(3)5(6)7/h3-4H,2H2,1H3,(H,6,7)
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Indigotrisulfonic Acid Potassium Salt
Cas Number: 67627-18-3Formula: C16H7K3N2O11S3Molecular weight: 616.71Synonyms: EINECS 249-102-9 | 5ZZA8N0ABT | MFCD00013160 | D91103 | TRIPOTASSIUM 3-OXO-2-(3-OXO-5-SULFONATO-1H-I...SMILES: C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)C(=N2)C3=C(C4=C(N3)C(=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[K+].[K+].[K+]InChIKey: BANKRXMWIUVRAN-UHFFFAOYSA-KInChI: InChI=1S/C16H10N2O11S3.3K/c19-15-8-3-6(30(21,22)23)1-2-10(8)17-13(15)14-16(20)9-4-7(31(24,25)26)5-11(12(9)18-14)32(27,28)29;;;/h1-5,18,20H,(H,21,22,23)(H,24,25,26)(H,27,28,29);;;/q;3*+1/p-3
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