Name: C.I. Acid red 154
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218847644
Cas No:6507-79-5
常用名:C.I. Acid red 154
IUPAC:disodium 3-[(1E)-2-[4-(1-{4-[(1E)-2-(1,7-dihydroxy-3-sulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}cyclohexyl)-2-methylphenyl]diazen-1-yl]-4,6-dihydroxynaphthalene-2-sulfonate
IUPAC:disodium 3-[(1E)-2-[4-(1-{4-[(1E)-2-(1,7-dihydroxy-3-sulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}cyclohexyl)-2-methylphenyl]diazen-1-yl]-4,6-dihydroxynaphthalene-2-sulfonate
InChI key:SWYAODARJIJAKL-KNZLDKEQSA-L

分子式:C40H34N4Na2O10S2
分子量:840.83
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[Na+].[Na+].Cc1cc(ccc1\N=N\c1c(O)c2cc(O)ccc2cc1S([O-])(=O)=O)C1(CCCCC1)c1ccc(\N=N\c2c(O)c3cc(O)ccc3cc2S([O-])(=O)=O)c(C)c1
SMILES:[Na+].[Na+].Cc1cc(ccc1\N=N\c1c(O)c2cc(O)ccc2cc1S([O-])(=O)=O)C1(CCCCC1)c1ccc(\N=N\c2c(O)c3cc(O)ccc3cc2S([O-])(=O)=O)c(C)c1

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