Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate hydrochloride (CAS 31539-88-5) — formula C9H13NO2, molecular weight 167.20; category organic chemicals.
| CAS Number | 31539-88-5 |
|---|---|
| Molecular Formula | C9H13NO2 |
| Molecular Weight | 167.20 |
| LogP | 0.8 |
| Category | Organic Chemicals |
Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate hydrochloride is a carbon-based organic compound with CAS registry number 31539-88-5 and molecular formula C9H13NO2 (molecular weight 167.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 31539-88-5
Its molecular formula C9H13NO2 comprises 9 C, 13 H, 1 N, 2 O atoms.
Also known as: Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate hydrochloride · 1-氮杂双环[2.2.2]辛-2-烯-3-甲酸甲酯，盐酸盐
Category: organic chemicals
The CAS registry number of Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate hydrochloride is 31539-88-5.
Molecular formula C9H13NO2, molecular weight 167.20.
It is also registered under: Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate hydrochloride, 1-氮杂双环[2.2.2]辛-2-烯-3-甲酸甲酯，盐酸盐.
Category: Organic Chemicals.
Independent reference data for Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate hydrochloride (CAS 31539-88-5), compiled from public chemistry databases.
| CAS 号 | 31539-88-5 |
|---|---|
| PubChem CID | 35834 |
| 分子式 | C9H13NO2 |
| IUPAC 名称 | methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate |
| Molecular Weight | 167.20 |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 167.094628657 |
| Monoisotopic Mass | 167.094628657 |
| Topological Polar Surface Area | 29.5 |
| Heavy Atom Count | 12 |
Methyl 1-azabicyclo[2.2.2]oct-2-ene-3-carboxylate; Dehydroquinuclidine-3-carboxylic acid; 31539-88-5; BRN 0132895; 1-AZABICYCLO(2.2.2)OCT-2-ENE-3-CARBOXYLIC ACID, METHYL ESTER; Methyl dehydroquinuclidine-3-carboxylate; DTXSID90185436; 5-22-01-00447 (Beilstein Handbook Reference); 1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid, methyl ester; Methyl 1-azabicyclo(2.2.2)oct-2-ene-3-carboxylate; RefChem:227601; DTXCID00107927; SDEKJEJGZPSNFT-UHFFFAOYSA-N; SCHEMBL7276868; STL552720; AKOS037502905
1-氮杂双环[2.2.2]辛-2-烯-3-甲酸甲酯，盐酸盐 · CAS 31539-88-5 · C9H13NO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.