C.I.直接蓝237
Trisodium (mu-(3-((4'-((6-anilino-1-hydroxy-3-sulpho-2-naphthyl)azo)-3,3'-dihydroxy(1,1'-biphenyl)-4-yl)azo)-4-hydroxynaphthalene-2,7-disulphonato(7-)))dicuprate(3-) · CAS 73507-22-9
- 中文名
- C.I.直接蓝237
- 中文别名
- 暂无
- 英文名
- Trisodium (mu-(3-((4'-((6-anilino-1-hydroxy-3-sulpho-2-naphthyl)azo)-3,3'-dihydroxy(1,1'-biphenyl)-4-yl)azo)-4-hydroxynaphthalene-2,7-disulphonato(7-)))dicuprate(3-)
- CAS
- 73507-22-9
- CID
- 136125632
- IUPAC 名称
- trisodium;3-[[4-[4-[(6-anilino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-3-hydroxyphenyl]-2-hydroxyphenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonic acid;copper
名称与编号
- 中文名
- C.I.直接蓝237
- 中文别名
- 暂无
- 英文名
- Trisodium (mu-(3-((4'-((6-anilino-1-hydroxy-3-sulpho-2-naphthyl)azo)-3,3'-dihydroxy(1,1'-biphenyl)-4-yl)azo)-4-hydroxynaphthalene-2,7-disulphonato(7-)))dicuprate(3-)
- CAS
- 73507-22-9
- CID
- 136125632
- IUPAC 名称
- trisodium;3-[[4-[4-[(6-anilino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-3-hydroxyphenyl]-2-hydroxyphenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonic acid;copper
分子属性
- 分子式
- C38H27Cu2N5Na3O13S3+3
- 分子量
- 1053.9 g/mol
- 精确质量
- 1051.905252 Da
- 单同位素质量
- 1051.905252 Da
- XLogP
- 暂无
- 极性表面积
- 331 Ų
- 氢键供体
- 8
- 氢键受体
- 18
- 可旋转键
- 3
- 重原子数
- 64
- 净电荷
- 3
- 结构复杂度
- 1850
结构标识
- InChIKey
- DRZWHGUGBGQBRP-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(C=C7C=C(C=CC7=C6O)S(=O)(=O)O)S(=O)(=O)O)O)O)S(=O)(=O)O.[Na+].[Na+].[Na+].[Cu].[Cu]
- InChI
- InChI=1S/C38H27N5O13S3.2Cu.3Na/c44-31-16-20(6-12-29(31)40-42-35-33(58(51,52)53)18-22-14-25(8-10-27(22)37(35)46)39-24-4-2-1-3-5-24)21-7-13-30(32(45)17-21)41-43-36-34(59(54,55)56)19-23-15-26(57(48,49)50)9-11-28(23)38(36)47;;;;;/h1-19,39,44-47H,(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;;/q;;;3*+1