C.I.分散黄227
3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-4-methyl-5-[2-[4-[4-(1-methylethyl)benzoyl]phenyl]diazenyl]-2-oxo- · CAS 73157-52-5
- 中文名
- C.I.分散黄227
- 中文别名
- 暂无
- 英文名
- 3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-4-methyl-5-[2-[4-[4-(1-methylethyl)benzoyl]phenyl]diazenyl]-2-oxo-
- CAS
- 73157-52-5
- CID
- 166405
- IUPAC 名称
- 2-hydroxy-4-methyl-6-oxo-5-[[4-(4-propan-2-ylbenzoyl)phenyl]diazenyl]-1H-pyridine-3-carbonitrile
名称与编号
- 中文名
- C.I.分散黄227
- 中文别名
- 暂无
- 英文名
- 3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-4-methyl-5-[2-[4-[4-(1-methylethyl)benzoyl]phenyl]diazenyl]-2-oxo-
- CAS
- 73157-52-5
- CID
- 166405
- IUPAC 名称
- 2-hydroxy-4-methyl-6-oxo-5-[[4-(4-propan-2-ylbenzoyl)phenyl]diazenyl]-1H-pyridine-3-carbonitrile
分子属性
- 分子式
- C23H20N4O3
- 分子量
- 400.4 g/mol
- 精确质量
- 400.15354051 Da
- 单同位素质量
- 400.15354051 Da
- XLogP
- 4.4
- 极性表面积
- 115 Ų
- 氢键供体
- 2
- 氢键受体
- 6
- 可旋转键
- 5
- 重原子数
- 30
- 净电荷
- 0
- 结构复杂度
- 830
结构标识
- InChIKey
- RWKZJPHHITZEIU-UHFFFAOYSA-N
- SMILES
- CC1=C(C(=O)NC(=C1C#N)O)N=NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C(C)C
- InChI
- InChI=1S/C23H20N4O3/c1-13(2)15-4-6-16(7-5-15)21(28)17-8-10-18(11-9-17)26-27-20-14(3)19(12-24)22(29)25-23(20)30/h4-11,13H,1-3H3,(H2,25,29,30)