1-(4-FLUOROBENZYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID (CAS 96449-68-2) — formula C12H12FNO3, molecular weight 237.23; category organic chemicals.
| CAS Number | 96449-68-2 |
|---|---|
| Molecular Formula | C12H12FNO3 |
| Molecular Weight | 237.23 |
| LogP | 0.6 |
| Category | Organic Chemicals |
1-(4-FLUOROBENZYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID is a carbon-based organic compound with CAS registry number 96449-68-2 and molecular formula C12H12FNO3 (molecular weight 237.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96449-68-2
Its molecular formula C12H12FNO3 comprises 12 C, 12 H, 1 F, 1 N, 3 O atoms.
Also known as: 1-(4-FLUOROBENZYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID · 1-(4-氟苄基)-5-氧代吡咯烷-3-羧酸
Category: organic chemicals
The CAS registry number of 1-(4-FLUOROBENZYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID is 96449-68-2.
Molecular formula C12H12FNO3, molecular weight 237.23.
It is also registered under: 1-(4-FLUOROBENZYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID, 1-(4-氟苄基)-5-氧代吡咯烷-3-羧酸.
Category: Organic Chemicals.
Independent reference data for 1-(4-FLUOROBENZYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID (CAS 96449-68-2), compiled from public chemistry databases.
| CAS 号 | 96449-68-2 |
|---|---|
| PubChem CID | 2780702 |
| 分子式 | C12H12FNO3 |
| IUPAC 名称 | 1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid |
| UNII（FDA） | HMS1513J05 |
| Molecular Weight | 237.23 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 237.08012141 |
| Monoisotopic Mass | 237.08012141 |
| Topological Polar Surface Area | 57.6 |
| Heavy Atom Count | 17 |
96449-68-2; 1-(4-fluorobenzyl)-5-oxopyrrolidine-3-carboxylic acid; 1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid; 1-(4-fluorobenzyl)-5-oxo-3-pyrrolidinecarboxylic acid; MFCD03086215; 3-Pyrrolidinecarboxylicacid, 1-[(4-fluorophenyl)methyl]-5-oxo-; 1-[(4-fluorophenyl)methyl]-5-oxo-pyrrolidine-3-carboxylic acid; SMR000033648; ChemDiv3_014283; MLS000047638; SCHEMBL7465720; CHEMBL1407153; DTXSID50381694; HMS1513J05; HMS2283H12; ALBB-000264
1-(4-氟苄基)-5-氧代吡咯烷-3-羧酸 · CAS 96449-68-2 · C12H12FNO3. UNII HMS1513J05.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-(4-氟苄基)-5-氧代吡咯烷-3-羧酸