3-PYRROLIDIN-1-YL-BENZOIC ACID (CAS 72548-79-9) — formula C11H13NO2, molecular weight 191.23; category organic chemicals.
| CAS Number | 72548-79-9 |
|---|---|
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.23 |
| LogP | 3.1 |
| Category | Organic Chemicals |
3-PYRROLIDIN-1-YL-BENZOIC ACID is a carbon-based organic compound with CAS registry number 72548-79-9 and molecular formula C11H13NO2 (molecular weight 191.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72548-79-9
Its molecular formula C11H13NO2 comprises 11 C, 13 H, 1 N, 2 O atoms.
Also known as: 3-PYRROLIDIN-1-YL-BENZOIC ACID · 3-(1-四氢吡咯基)苯甲酸
Category: organic chemicals
The CAS registry number of 3-PYRROLIDIN-1-YL-BENZOIC ACID is 72548-79-9.
Molecular formula C11H13NO2, molecular weight 191.23.
It is also registered under: 3-PYRROLIDIN-1-YL-BENZOIC ACID, 3-(1-四氢吡咯基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 3-PYRROLIDIN-1-YL-BENZOIC ACID (CAS 72548-79-9), compiled from public chemistry databases.
| CAS 号 | 72548-79-9 |
|---|---|
| PubChem CID | 651721 |
| 分子式 | C11H13NO2 |
| IUPAC 名称 | 3-pyrrolidin-1-ylbenzoic acid |
| UNII（FDA） | HMS1376F03 |
| Molecular Weight | 191.23 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 191.094628657 |
| Monoisotopic Mass | 191.094628657 |
| Topological Polar Surface Area | 40.5 |
| Heavy Atom Count | 14 |
3-(pyrrolidin-1-yl)benzoic acid; RefChem:496120; 629-982-4; 72548-79-9; 3-Pyrrolidin-1-yl-benzoic acid; 3-pyrrolidin-1-ylbenzoic acid; 3-(1-pyrrolidinyl)benzoic acid; MFCD03426724; MLS000124101; SMR000013242; 3-pyrrolidinylbenzoic acid; Benzoic acid, 3-(1-pyrrolidinyl)-; 1-(3-Carboxyphenyl)pyrrolidine; 3-(Pyrrolidin-1-yl); 3-pyrrolidinobenzoic acid; ChemDiv2_002577
| 已通报的危害声明 | H302 (50%), H315 (100%), H319 (100%), H335 (100%) |
|---|
3-(1-四氢吡咯基)苯甲酸 · CAS 72548-79-9 · C11H13NO2. UNII HMS1376F03.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(1-四氢吡咯基)苯甲酸