间羟基苯甲酰爱康宁，CAS 登记号 129944-99-6，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-HYDROXYBENZOYLECGONINE · CAS 129944-99-6 · C16H19NO5. UNII XD3FI6U4BP.
| CAS Registry Number | 129944-99-6 |
|---|---|
| PubChem CID | 448357 |
| Molecular formula | C16H19NO5 |
| IUPAC name | (1R,2R,3S,5S)-3-(3-hydroxybenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid |
| UNII (FDA) | XD3FI6U4BP |
| Molecular Weight | 305.32 |
|---|---|
| XLogP3 | -0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 305.12632271 |
| Monoisotopic Mass | 305.12632271 |
| Topological Polar Surface Area | 87.1 |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Reported hazard statements | H302 (100%), H312 (100%), H317 (100%), H332 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
3-Hydroxybenzoylecgonine; 129944-99-6; m-Hydroxybenzoylecgonine; XD3FI6U4BP; DTXSID40926533; 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-((3-hydroxybenzoyl)oxy)-8-methyl-, (1R-(exo,exo))-; RefChem:502531; DTXCID201513191; 634-168-7; meta-hydroxybenzoylecgonine; (1R,2R,3S,5S)-3-(3-hydroxybenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic Acid; 3-(3-HYDROXY-BENZOYLOXY)-8-METHYL-8-AZA-BICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID; (1R,2R,3S,5S)-3-((3-Hydroxybenzoyl)oxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid; (1R,2R,3S,5S)-3-[(3-Hydroxybenzoyl)oxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid; (1R,2R,3S,5S)-3-((3-HYDROXYBENZOYL)OXY)-8-METHYL-8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID; (1R,2R,3S,5S)-3-(3-HYDROXYBENZOYLOXY)-8-METHYL-8-AZABICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID
CAS 129944-99-6; molecular formula C16H19NO5; molecular weight — g/mol.
3-Hydroxybenzoylecgonine, 129944-99-6, m-Hydroxybenzoylecgonine, XD3FI6U4BP, DTXSID40926533, 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-((3-hydroxybenzoyl)oxy)-8-methyl-, (1R-(exo,exo))-.
Hazard statements reported: H302, H312, H317, H332.
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.