1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid (CAS 96449-64-8) — formula C14H17NO5, molecular weight 279.29; category organic chemicals.
| CAS Number | 96449-64-8 |
|---|---|
| Molecular Formula | C14H17NO5 |
| Molecular Weight | 279.29 |
| LogP | 0.4 |
| Category | Organic Chemicals |
1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid is a carbon-based organic compound with CAS registry number 96449-64-8 and molecular formula C14H17NO5 (molecular weight 279.29), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96449-64-8
Its molecular formula C14H17NO5 comprises 14 C, 17 H, 1 N, 5 O atoms.
Also known as: 1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid · 1-(3,4-二甲氧基苄基)-5-氧代吡咯烷-3-羧酸
Category: organic chemicals
The CAS registry number of 1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid is 96449-64-8.
Molecular formula C14H17NO5, molecular weight 279.29.
It is also registered under: 1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid, 1-(3,4-二甲氧基苄基)-5-氧代吡咯烷-3-羧酸.
Category: Organic Chemicals.
Independent reference data for 1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid (CAS 96449-64-8), compiled from public chemistry databases.
| CAS 号 | 96449-64-8 |
|---|---|
| PubChem CID | 13422553 |
| 分子式 | C14H17NO5 |
| IUPAC 名称 | 1-[(3,4-dimethoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid |
| UNII（FDA） | ST50404946 |
| Molecular Weight | 279.29 |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 279.11067264 |
| Monoisotopic Mass | 279.11067264 |
| Topological Polar Surface Area | 76.1 |
| Heavy Atom Count | 20 |
96449-64-8; 1-(3,4-DIMETHOXY-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID; 1-[(3,4-dimethoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid; MFCD08164341; 1-(3,4-dimethoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid; SCHEMBL10639471; LAGVWNLMHYIYJP-UHFFFAOYSA-N; BBL034964; SBB016530; STL419945; AKOS000302025; AKOS016045396; AS-5203; CS-0312718; ST50404946; AS-871/43475801
1-(3,4-二甲氧基苄基)-5-氧代吡咯烷-3-羧酸 · CAS 96449-64-8 · C14H17NO5. UNII ST50404946.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.