C.I.酸性红318
Hydrogen bis(3-(4,5-dihydro-4-((2-hydroxy-5-methyl-3-nitrophenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzene-1-sulphonamidato(2-))chromate(1-) · CAS 51472-11-8
- 中文名
- C.I.酸性红318
- 中文别名
- 暂无
- 英文名
- Hydrogen bis(3-(4,5-dihydro-4-((2-hydroxy-5-methyl-3-nitrophenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzene-1-sulphonamidato(2-))chromate(1-)
- CAS
- 51472-11-8
- CID
- 76871847
- IUPAC 名称
- chromium;hydron;bis(3-[4-[(2-hydroxy-5-methyl-3-nitrophenyl)diazenyl]-3-methyl-5-oxopyrazol-4-id-1-yl]benzenesulfonamide)
名称与编号
- 中文名
- C.I.酸性红318
- 中文别名
- 暂无
- 英文名
- Hydrogen bis(3-(4,5-dihydro-4-((2-hydroxy-5-methyl-3-nitrophenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzene-1-sulphonamidato(2-))chromate(1-)
- CAS
- 51472-11-8
- CID
- 76871847
- IUPAC 名称
- chromium;hydron;bis(3-[4-[(2-hydroxy-5-methyl-3-nitrophenyl)diazenyl]-3-methyl-5-oxopyrazol-4-id-1-yl]benzenesulfonamide)
分子属性
- 分子式
- C34H31CrN12O12S2-
- 分子量
- 915.8 g/mol
- 精确质量
- 915.103087 Da
- 单同位素质量
- 915.103087 Da
- XLogP
- 暂无
- 极性表面积
- 384 Ų
- 氢键供体
- 5
- 氢键受体
- 22
- 可旋转键
- 4
- 重原子数
- 61
- 净电荷
- -1
- 结构复杂度
- 1850
结构标识
- InChIKey
- XBDILBGXBATPAY-UHFFFAOYSA-O
- SMILES
- [H+].CC1=CC(=C(C(=C1)[N+](=O)[O-])O)N=N[C-]2C(=NN(C2=O)C3=CC(=CC=C3)S(=O)(=O)N)C.CC1=CC(=C(C(=C1)[N+](=O)[O-])O)N=N[C-]2C(=NN(C2=O)C3=CC(=CC=C3)S(=O)(=O)N)C.[Cr]
- InChI
- InChI=1S/2C17H15N6O6S.Cr/c2*1-9-6-13(16(24)14(7-9)23(26)27)19-20-15-10(2)21-22(17(15)25)11-4-3-5-12(8-11)30(18,28)29;/h2*3-8,24H,1-2H3,(H2,18,28,29);/q2*-1;/p+1