(E)-5-(3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl)-3-methylpent-2-enoic acid
(E)-5-(3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl)-3-methylpent-2-enoic acid · CAS 113626-22-5
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (E)-5-(3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl)-3-methylpent-2-enoic acid
- CAS
- 113626-22-5
- CID
- 13858200
- IUPAC 名称
- (E)-5-(3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl)-3-methylpent-2-enoic acid
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (E)-5-(3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl)-3-methylpent-2-enoic acid
- CAS
- 113626-22-5
- CID
- 13858200
- IUPAC 名称
- (E)-5-(3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl)-3-methylpent-2-enoic acid
分子属性
- 分子式
- C20H30O2
- 分子量
- 302.5 g/mol
- 精确质量
- 302.224580195 Da
- 单同位素质量
- 302.224580195 Da
- XLogP
- 5.8
- 极性表面积
- 37.3 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 4
- 重原子数
- 22
- 净电荷
- 0
- 结构复杂度
- 532
结构标识
- InChIKey
- PCLDEDSUWNZZDJ-ACCUITESSA-N
- SMILES
- C/C(=C\C(=O)O)/CCC1C(=C)CCC2C1(CCC3C2(C3)C)C
- InChI
- InChI=1S/C20H30O2/c1-13(11-18(21)22)5-7-16-14(2)6-8-17-19(16,3)10-9-15-12-20(15,17)4/h11,15-17H,2,5-10,12H2,1,3-4H3,(H,21,22)/b13-11+