C.I.直接蓝200
Cuprate(4-), (mu-(7-((3,3'-dihydroxy-4'-((1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl)azo)(1,1'-biphenyl)-4-yl)azo)-8-hydroxy-1,3,6-naphthalenetrisulfonato(8-)))di-, tetrasodium · CAS 72927-72-1
- 中文名
- C.I.直接蓝200
- 中文别名
- 暂无
- 英文名
- Cuprate(4-), (mu-(7-((3,3'-dihydroxy-4'-((1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl)azo)(1,1'-biphenyl)-4-yl)azo)-8-hydroxy-1,3,6-naphthalenetrisulfonato(8-)))di-, tetrasodium
- CAS
- 72927-72-1
- CID
- 136192486
- IUPAC 名称
- tetrasodium;7-[[4-[4-[(6-anilino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-3-hydroxyphenyl]-2-hydroxyphenyl]diazenyl]-8-hydroxynaphthalene-1,3,6-trisulfonic acid;copper
名称与编号
- 中文名
- C.I.直接蓝200
- 中文别名
- 暂无
- 英文名
- Cuprate(4-), (mu-(7-((3,3'-dihydroxy-4'-((1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl)azo)(1,1'-biphenyl)-4-yl)azo)-8-hydroxy-1,3,6-naphthalenetrisulfonato(8-)))di-, tetrasodium
- CAS
- 72927-72-1
- CID
- 136192486
- IUPAC 名称
- tetrasodium;7-[[4-[4-[(6-anilino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-3-hydroxyphenyl]-2-hydroxyphenyl]diazenyl]-8-hydroxynaphthalene-1,3,6-trisulfonic acid;copper
分子属性
- 分子式
- C38H27Cu2N5Na4O16S4+4
- 分子量
- 1157 g/mol
- 精确质量
- 1154.851836 Da
- 单同位素质量
- 1154.851836 Da
- XLogP
- 暂无
- 极性表面积
- 393 Ų
- 氢键供体
- 9
- 氢键受体
- 21
- 可旋转键
- 4
- 重原子数
- 69
- 净电荷
- 4
- 结构复杂度
- 2120
结构标识
- InChIKey
- FGMABLXDGUWFNG-UHFFFAOYSA-N
- SMILES
- C1=CC=C(C=C1)NC2=CC3=CC(=C(C(=C3C=C2)O)N=NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N=NC6=C(C7=C(C=C(C=C7C=C6S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)O)O)O)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]
- InChI
- InChI=1S/C38H27N5O16S4.2Cu.4Na/c44-29-14-19(6-10-27(29)40-42-35-32(62(54,55)56)16-21-12-24(8-9-26(21)37(35)46)39-23-4-2-1-3-5-23)20-7-11-28(30(45)15-20)41-43-36-33(63(57,58)59)17-22-13-25(60(48,49)50)18-31(61(51,52)53)34(22)38(36)47;;;;;;/h1-18,39,44-47H,(H,48,49,50)(H,51,52,53)(H,54,55,56)(H,57,58,59);;;;;;/q;;;4*+1