2,2,4-trimethyl-1-pentanol
1-pentanol, 2,2,4-trimethyl-
Identification
| Name | 2,2,4-trimethyl-1-pentanol |
| CAS Number | 123-44-4 |
| EINECS | 204-628-8 |
| FDA UNII | IX60R7GK8R |
| Molecular Formula | C8 H18 O |
| Molecular Weight | 130.23066000 |
| MDL Number | MFCD00021979 |
| Nikkaji Number | J49.949H |
| Beilstein | 1697386 |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 157.00 to 158.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 0.496000 mmHg (est) |
| Flash Point | 134.00 °F. TCC ( 56.60 °C. ) (est) |
| logP (o/w) | 2.466 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
No sensory data available
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | oral-rat LD50 2140 ul/kg |
| Dermal Toxicity | skin-rabbit LD50 2830 ul/kg |
| 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 | natural substances and extractives |
| Recommendation for 2,2,4-trimethyl-1-pentanol usage levels up to | not for fragrance use. |
| Recommendation for 2,2,4-trimethyl-1-pentanol flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
2,2,4-
diisopropyl methyl carbinol
1-
pentanol, 2,2,4-trimethyl-
2,2,4-
trimethyl pentan-1-ol
2,2,4-
trimethylpentan-1-ol
2,2,4-
trimethylpentanol
PubMed:
Characteristics of chemical binding to alpha 2u-globulin in vitro--evaluating structure-activity relationships.
PubMed:
Identification of urinary metabolites of the nephrotoxic hydrocarbon 2,2,4-trimethylpentane in male rats.