4-tert-butyl benzaldehyde
benzaldehyde, 4-(1,1-dimethylethyl)-
Identification
| Name | 4-tert-butyl benzaldehyde |
| IUPAC | 4-tert-butylbenzaldehyde |
| CAS Number | 939-97-9 |
| EINECS | 213-367-9 |
| FDA UNII | QXF0QY8503 |
| Molecular Formula | C11 H14 O |
| Molecular Weight | 162.23178000 |
| MDL Number | MFCD00035742 |
| Nikkaji Number | J298.539J |
| Beilstein | 1906461 |
| XlogP3 | 3.10 (est) |
Regulatory
Physical Properties
| Appearance | colorless to pale yellow clear liquid (est) |
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 240.80 °C. @ 760.00 mm Hg (est) |
| Flash Point | 206.00 °F. TCC ( 96.90 °C. ) (est) |
| logP (o/w) | 3.330 (est) |
| Soluble in | water, 54.18 mg/L @ 25 °C (est) |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | fragrance |
No sensory data available
Safety Information
| Preferred SDS | View |
| 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 | cosmetic fragrance agents and aromatic raw materials |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for 4-tert-butyl benzaldehyde flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
benzaldehyde, 4-(1,1-dimethylethyl)-
benzaldehyde, p-tert-butyl-
4-t-
butyl benzaldehyde
4-(t-
butyl)benzaldehyde
4-(tert-
butyl)benzaldehyde
4-t-
butylbenzaldehyde
4-tert-
butylbenzaldehyde
p-t-
butylbenzaldehyde
p-tert-
butylbenzaldehyde
4-(1,1-
dimethylethyl)-benzaldehyde
4-(2-
methyl-2-propanyl)benzaldehyde
Google Patents:
Process for the preparation of 4-tert-butylbenzaldehyde
PubMed:
Catalytic scope of the thiamine-dependent multifunctional enzyme cyclohexane-1,2-dione hydrolase.
PubMed:
Partial oxidation of 4-tert-butyltoluene catalyzed by homogeneous cobalt and cerium acetate catalysts in the Br-/H2O2/acetic acid system: insights into selectivity and mechanism.
PubMed:
Environmental green chemistry as defined by photocatalysis.
PubMed:
A MALDI-chip integrated system with a monitoring window.