活性紫K-3R
Copper;disodium;5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;5-[(4-chloro-6-phenoxy-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;copper(1+) · CAS 8063-57-8
- 中文名
- 活性紫K-3R
- 中文别名
- 暂无
- 英文名
- Copper;disodium;5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;5-[(4-chloro-6-phenoxy-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;copper(1+)
- CAS
- 8063-57-8
- CID
- 172878367
- IUPAC 名称
- copper;disodium;5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;5-[(4-chloro-6-phenoxy-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;copper(1+)
名称与编号
- 中文名
- 活性紫K-3R
- 中文别名
- 暂无
- 英文名
- Copper;disodium;5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;5-[(4-chloro-6-phenoxy-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;copper(1+)
- CAS
- 8063-57-8
- CID
- 172878367
- IUPAC 名称
- copper;disodium;5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;5-[(4-chloro-6-phenoxy-1,3,5-triazin-2-yl)amino]-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate;copper(1+)
分子属性
- 分子式
- C44H21Cl2Cu2N13Na2O23S6-
- 分子量
- 1536.1 g/mol
- 精确质量
- 1532.696189 Da
- 单同位素质量
- 1532.696189 Da
- XLogP
- 暂无
- 极性表面积
- 672 Ų
- 氢键供体
- 3
- 氢键受体
- 36
- 可旋转键
- 6
- 重原子数
- 92
- 净电荷
- -5
- 结构复杂度
- 2660
结构标识
- InChIKey
- ZEZSKAALLRIROR-UHFFFAOYSA-D
- SMILES
- C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=C4[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])Cl.C1=CC(=C(C=C1S(=O)(=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)N)Cl)[O-])[O-].[Na+].[Na+].[Cu+].[Cu+2]
- InChI
- InChI=1S/C25H17ClN6O12S3.C19H14ClN7O11S3.2Cu.2Na/c26-23-28-24(30-25(29-23)44-13-4-2-1-3-5-13)27-17-11-15(46(38,39)40)8-12-9-19(47(41,42)43)21(22(34)20(12)17)32-31-16-10-14(45(35,36)37)6-7-18(16)33;20-17-23-18(21)25-19(24-17)22-11-6-9(40(33,34)35)3-7-4-13(41(36,37)38)15(16(29)14(7)11)27-26-10-5-8(39(30,31)32)1-2-12(10)28;;;;/h1-11,33-34H,(H,35,36,37)(H,38,39,40)(H,41,42,43)(H,27,28,29,30);1-6,28-29H,(H,30,31,32)(H,33,34,35)(H,36,37,38)(H3,21,22,23,24,25);;;;/q;;+1;+2;2*+1/p-10