间(1-氰乙基)苯甲酸,CAS 登记号 5537-71-3,由济南圣和化工有限公司现货供应,可提供纯度 按批次COA提供(不公开发布) 的规格,下游主要用于有机化学品。支持样品与小批量试用,批量价格请联系我们获取,验收以批次 COA 为准。
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m-(1-cyanoethyl)benzoic acid · CAS 5537-71-3 · C10H9NO2. UNII 3PN2M0G40N.
| 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 |
| Formal Charge | 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]
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
CAS 5537-71-3; molecular formula C10H9NO2; molecular weight — g/mol.
3-(1-Cyanoethyl)benzoic acid, 5537-71-3, m-(1-Cyanoethyl)benzoic acid, Benzoic acid, 3-(1-cyanoethyl)-, UNII-3PN2M0G40N, 3PN2M0G40N.
Hazard statements reported: H302, H317, H318.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.