酸性红374

CAS号
6507-78-4
CCD编号
CCD08275939
分子式
C38 H29 N4 O11 S3 . 3 Na
分子量
882.832

基本信息

产品名称: 酸性红374
CAS: 6507-78-4
中文同义词: 酸性红374
英文同义词: TRISODIUM 7-HYDROXY-8-[[4-[1-[4-[(1-HYDROXY-4-SULPHONATO-2-NAPHTHYL)AZO]PHENYL]CYCLOHEXYL]PHENYL]AZO]NAPHTHALENE-1,3-DISULPHONATE ; CI ACID RED 374
MDL号: MFCD23160438
氢键受体数量: 15
氢键供体数量: 2
Smile: c1ccc2c(c1)c(cc(c2O)/N=N/c3ccc(cc3)C4(CCCCC4)c5ccc(cc5)/N=N/c6c(ccc7c6c(cc(c7)S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi: InChI=1S/C38H32N4O11S3.3Na/c43-32-17-8-23-20-28(54(45,46)47)21-34(56(51,52)53)35(23)36(32)42-40-27-15-11-25(12-16-27)38(18-4-1-5-19-38)24-9-13-26(14-10-24)39-41-31-22-33(55(48,49)50)29-6-2-3-7-30(29)37(31)44;;;/h2-3,6-17,20-22,43-44H,1,4-5,18-19H2,(H,45,46,47)(H,48,49,50)(H,51,52,53);;;/q;3*+1/p-3/b41-39+,42-40+;;;
InChiKey: InChIKey=NWOFPTMLQCEISY-IZOAXSFUSA-K

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