(12-Methyl-4-methylidene-14,19-dioxa-17-azaheptacyclo[10.7.2.22,5.02,7.08,18.08,21.013,17]tricosan-20-yl) acetate
(12-Methyl-4-methylidene-14,19-dioxa-17-azaheptacyclo[10.7.2.22,5.02,7.08,18.08,21.013,17]tricosan-20-yl) acetate · CAS 21040-64-2
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (12-Methyl-4-methylidene-14,19-dioxa-17-azaheptacyclo[10.7.2.22,5.02,7.08,18.08,21.013,17]tricosan-20-yl) acetate
- CAS
- 21040-64-2
- CID
- 12442946
- IUPAC 名称
- (12-methyl-4-methylidene-14,19-dioxa-17-azaheptacyclo[10.7.2.22,5.02,7.08,18.08,21.013,17]tricosan-20-yl) acetate
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (12-Methyl-4-methylidene-14,19-dioxa-17-azaheptacyclo[10.7.2.22,5.02,7.08,18.08,21.013,17]tricosan-20-yl) acetate
- CAS
- 21040-64-2
- CID
- 12442946
- IUPAC 名称
- (12-methyl-4-methylidene-14,19-dioxa-17-azaheptacyclo[10.7.2.22,5.02,7.08,18.08,21.013,17]tricosan-20-yl) acetate
分子属性
- 分子式
- C24H33NO4
- 分子量
- 399.5 g/mol
- 精确质量
- 399.24095853 Da
- 单同位素质量
- 399.24095853 Da
- XLogP
- 3.6
- 极性表面积
- 48 Ų
- 氢键供体
- 0
- 氢键受体
- 5
- 可旋转键
- 2
- 重原子数
- 29
- 净电荷
- 0
- 结构复杂度
- 813
结构标识
- InChIKey
- HSZMQRORNAEJTB-UHFFFAOYSA-N
- SMILES
- CC(=O)OC1C2C3(CCCC24C5CC6CCC5(C1OC4N7C3OCC7)CC6=C)C
- InChI
- InChI=1S/C24H33NO4/c1-13-12-23-8-5-15(13)11-16(23)24-7-4-6-22(3)18(24)17(28-14(2)26)19(23)29-21(24)25-9-10-27-20(22)25/h15-21H,1,4-12H2,2-3H3