methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate (CAS 91108-31-5) — formula C10H17NO3, molecular weight 199.25; category organic chemicals.
| CAS Number | 91108-31-5 |
|---|---|
| Molecular Formula | C10H17NO3 |
| Molecular Weight | 199.25 |
| LogP | 0.6 |
| Category | Organic Chemicals |
methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate is a carbon-based organic compound with CAS registry number 91108-31-5 and molecular formula C10H17NO3 (molecular weight 199.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91108-31-5
Its molecular formula C10H17NO3 comprises 10 C, 17 H, 1 N, 3 O atoms.
Also known as: 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
Category: organic chemicals
The CAS registry number of methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate is 91108-31-5.
Molecular formula C10H17NO3, molecular weight 199.25.
It is also registered under: 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.
Category: Organic Chemicals.
Independent reference data for methyl (1S,2R,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine- 1-carboxylate (CAS 91108-31-5), compiled from public chemistry databases.
| 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.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.