2-(4-Hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)propyl 4-methylbenzenesulfonate
2-(4-Hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)propyl 4-methylbenzenesulfonate · CAS 66774-80-9
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- 2-(4-Hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)propyl 4-methylbenzenesulfonate
- CAS
- 66774-80-9
- CID
- 13519429
- IUPAC 名称
- 2-(4-hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)propyl 4-methylbenzenesulfonate
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- 2-(4-Hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)propyl 4-methylbenzenesulfonate
- CAS
- 66774-80-9
- CID
- 13519429
- IUPAC 名称
- 2-(4-hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)propyl 4-methylbenzenesulfonate
分子属性
- 分子式
- C20H30O4S
- 分子量
- 366.5 g/mol
- 精确质量
- 366.18648061 Da
- 单同位素质量
- 366.18648061 Da
- XLogP
- 4.6
- 极性表面积
- 72 Ų
- 氢键供体
- 1
- 氢键受体
- 4
- 可旋转键
- 5
- 重原子数
- 25
- 净电荷
- 0
- 结构复杂度
- 547
结构标识
- InChIKey
- CZKSQENRQZPNOS-UHFFFAOYSA-N
- SMILES
- CC1=CC=C(C=C1)S(=O)(=O)OCC(C)C2CCC3C2(CCCC3O)C
- InChI
- InChI=1S/C20H30O4S/c1-14-6-8-16(9-7-14)25(22,23)24-13-15(2)17-10-11-18-19(21)5-4-12-20(17,18)3/h6-9,15,17-19,21H,4-5,10-13H2,1-3H3