(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯(CAS 91108-31-5):分子式 C10H17NO3、分子量 199.25。
| CAS号 | 91108-31-5 |
|---|---|
| 分子式 | C10H17NO3 |
| 分子量 | 199.25 |
| LogP | 0.6 |
(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯 是一种化工化合物,登记 CAS 号为 91108-31-5,分子式 C10H17NO3(分子量 199.25)。
登记 CAS 号:91108-31-5
其分子式 C10H17NO3 由 10 个碳、17 个氢、1 个氮、3 个氧 组成。
别名/同义词:(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯 · methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate
(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯 的 CAS 登记号为 91108-31-5。
分子式 C10H17NO3,分子量 199.25。
别名/同义词:(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯、methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate。
(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯(CAS 91108-31-5)的独立参考数据,整理自公开化学数据库。
| CAS 号 | 91108-31-5 |
|---|---|
| PubChem CID | 149801 |
| 分子式 | C10H17NO3 |
| IUPAC 名称 | methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine-1-carboxylate |
| UNII(FDA) | 1H26FL57DF |
| Molecular Weight | 199.25 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 199.12084340 |
| Monoisotopic Mass | 199.12084340 |
| Topological Polar Surface Area | 49.8 |
| Heavy Atom Count | 14 |
Isotussilagine; (+)-Isotussilagine; Isotussilagine, (+)-; 91108-32-6; 1H26FL57DF; methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine-1-carboxylate; 1H-Pyrrolizine-1-carboxylic acid, hexahydro-2-hydroxy-2-methyl-, methyl ester, (1S,2R,7aS)-; 1H-Pyrrolizine-1-carboxylic acid, hexahydro-2-hydroxy-2-methyl-, methyl ester, (1S-(1alpha,2beta,7aalpha))-; RefChem:1087851; 91108-31-5; (+-)-Tussilagine; UNII-1H26FL57DF; orb1992614; SCHEMBL30899615; AKOS040734104; T123941
(1S,2R,8S)-2-羟基-2-甲基-1,3,5,6,7,8-六氢吡咯嗪-1-羧酸甲酯 · CAS 91108-31-5 · C10H17NO3. UNII 1H26FL57DF.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate