butyl vanillate
vanillic acid, N-butyl ester
Identification
| Name | butyl vanillate |
| IUPAC | butyl 4-hydroxy-3-methoxybenzoate |
| CAS Number | 5348-74-3 |
| EINECS | 226-307-1 |
| FDA UNII | Search |
| Molecular Formula | C12 H16 O4 |
| Molecular Weight | 224.25632000 |
| Nikkaji Number | J169.167H |
| XlogP3 | 3.00 (est) |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 343.00 to 344.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 0.000036 mmHg @ 25.00 °C. (est) |
| Flash Point | 261.00 °F. TCC ( 127.50 °C. ) (est) |
| logP (o/w) | 3.760 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
No sensory data available
Safety Information
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | information only not used for fragrances or flavors |
| Recommendation for butyl vanillate usage levels up to | not for fragrance use. |
| Recommendation for butyl vanillate flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
benzoic acid, 4-hydroxy-3-methoxy-, butyl ester
butyl 4-hydroxy-3-methoxybenzoate
vanillic acid N-butyl ester
vanillic acid, N-butyl ester
PubMed:
Antioxidative properties of vanillic acid esters in multiple antioxidant assays.
J-Stage:
Antioxidative Properties of Vanillic Acid Esters in Multiple Antioxidant Assays
PubMed:
Hedge mustard (Sisymbrium officinale): chemical diversity of volatiles and their antimicrobial activity.
PubMed:
Purification and characterization of PrbA, a new esterase from Enterobacter cloacae hydrolyzing the esters of 4-hydroxybenzoic acid (parabens).