C.I.酸性青莲54
2,7-Naphthalenedisulfonic acid, 3-(2-(2,4-bis(2-methylphenoxy)phenyl)diazenyl)-4-hydroxy-5-(((4-methylphenyl)sulfonyl)amino)-, sodium salt (1:2) · CAS 70210-05-8
- 中文名
- C.I.酸性青莲54
- 中文别名
- 暂无
- 英文名
- 2,7-Naphthalenedisulfonic acid, 3-(2-(2,4-bis(2-methylphenoxy)phenyl)diazenyl)-4-hydroxy-5-(((4-methylphenyl)sulfonyl)amino)-, sodium salt (1:2)
- CAS
- 70210-05-8
- CID
- 166112
- IUPAC 名称
- disodium;3-[[2,4-bis(2-methylphenoxy)phenyl]diazenyl]-4-hydroxy-5-[(4-methylphenyl)sulfonylamino]naphthalene-2,7-disulfonate
名称与编号
- 中文名
- C.I.酸性青莲54
- 中文别名
- 暂无
- 英文名
- 2,7-Naphthalenedisulfonic acid, 3-(2-(2,4-bis(2-methylphenoxy)phenyl)diazenyl)-4-hydroxy-5-(((4-methylphenyl)sulfonyl)amino)-, sodium salt (1:2)
- CAS
- 70210-05-8
- CID
- 166112
- IUPAC 名称
- disodium;3-[[2,4-bis(2-methylphenoxy)phenyl]diazenyl]-4-hydroxy-5-[(4-methylphenyl)sulfonylamino]naphthalene-2,7-disulfonate
分子属性
- 分子式
- C37H29N3Na2O11S3
- 分子量
- 833.8 g/mol
- 精确质量
- 833.07596083 Da
- 单同位素质量
- 833.07596083 Da
- XLogP
- 暂无
- 极性表面积
- 249 Ų
- 氢键供体
- 2
- 氢键受体
- 14
- 可旋转键
- 9
- 重原子数
- 56
- 净电荷
- 0
- 结构复杂度
- 1580
结构标识
- InChIKey
- PDIPEOFKXSOHMI-UHFFFAOYSA-L
- SMILES
- CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3O)N=NC4=C(C=C(C=C4)OC5=CC=CC=C5C)OC6=CC=CC=C6C)S(=O)(=O)[O-].[Na+].[Na+]
- InChI
- InChI=1S/C37H31N3O11S3.2Na/c1-22-12-15-27(16-13-22)52(42,43)40-30-21-28(53(44,45)46)18-25-19-34(54(47,48)49)36(37(41)35(25)30)39-38-29-17-14-26(50-31-10-6-4-8-23(31)2)20-33(29)51-32-11-7-5-9-24(32)3;;/h4-21,40-41H,1-3H3,(H,44,45,46)(H,47,48,49);;/q;2*+1/p-2