m-(1-cyanoethyl)benzoic acid (CAS 5537-71-3) — formula C10H9NO2, molecular weight 175.18; category organic chemicals.
| CAS Number | 5537-71-3 |
|---|---|
| Molecular Formula | C10H9NO2 |
| Molecular Weight | 175.18 |
| LogP | 2.2 |
| Category | Organic Chemicals |
m-(1-cyanoethyl)benzoic acid is a carbon-based organic compound with CAS registry number 5537-71-3 and molecular formula C10H9NO2 (molecular weight 175.18), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5537-71-3
Its molecular formula C10H9NO2 comprises 10 C, 9 H, 1 N, 2 O atoms.
Also known as: m-(1-cyanoethyl)benzoic acid · 间(1-氰乙基)苯甲酸
Category: organic chemicals
The CAS registry number of m-(1-cyanoethyl)benzoic acid is 5537-71-3.
Molecular formula C10H9NO2, molecular weight 175.18.
It is also registered under: m-(1-cyanoethyl)benzoic acid, 间(1-氰乙基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for m-(1-cyanoethyl)benzoic acid (CAS 5537-71-3), compiled from public chemistry databases.
| CAS Registry Number | 5537-71-3 |
|---|---|
| PubChem CID | 98370 |
| Molecular formula | C10H9NO2 |
| IUPAC name | 3-(1-cyanoethyl)benzoic acid |
| UNII (FDA) | 3PN2M0G40N |
| Molecular Weight | 175.18 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 175.063328530 |
| Monoisotopic Mass | 175.063328530 |
| Topological Polar Surface Area | 61.1 |
| Heavy Atom Count | 13 |
3-(1-Cyanoethyl)benzoic acid; 5537-71-3; m-(1-Cyanoethyl)benzoic acid; Benzoic acid, 3-(1-cyanoethyl)-; UNII-3PN2M0G40N; 3PN2M0G40N; 2-(3-carboxyphenyl)propionitrile; 2-(3-carboxyphenyl)propiononitrile; EINECS 226-897-0; NSC-113992; 3-(1-Cyanethyl)benzoesaeure; meta-(1-cyanoethyl)benzoic acid; acide 3-(1-cyanoethyl)benzoique; CHEBI:85131; 2-(3-carboxyphenyl)propanenitrile; EC 226-897-0
| Reported hazard statements | H302 (95.5%), H317 (90.9%), H318 (90.9%) |
|---|
H302 (95.5%): Harmful if swallowed [Warning Acute toxicity, oral]
H317 (90.9%): May cause an allergic skin reaction [Warning Sensitization, Skin]
m-(1-cyanoethyl)benzoic acid · CAS 5537-71-3 · C10H9NO2. UNII 3PN2M0G40N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 间(1-氰乙基)苯甲酸