4-heptanol
dipropyl carbinol
Identification
| Name | 4-heptanol |
| IUPAC | heptan-4-ol |
| CAS Number | 589-55-9 |
| EINECS | 209-651-7 |
| FDA UNII | YG7B8091BP |
| Molecular Formula | C7 H16 O |
| Molecular Weight | 116.20372000 |
| MDL Number | MFCD00021934 |
| Nikkaji Number | J95.498E |
| CoE Number | 555 |
| XlogP3 | 2.20 (est) |
Regulatory
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 99.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Melting Point | -41.20 °C. @ 760.00 mm Hg |
| Boiling Point | 156.00 to 158.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.792000 mmHg @ 25.00 °C. (est) |
| Flash Point | 118.00 °F. TCC ( 47.78 °C. ) |
| logP (o/w) | 2.220 |
| Soluble in | alcohol |
Organoleptic Properties
| Odor Description | at 100.00 %. |
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 | information only not used for fragrances or flavors |
| Recommendation for 4-heptanol usage levels up to | not for fragrance use. |
| Recommendation for 4-heptanol flavor usage levels up to | not for flavor use. |
Penta International Corporation
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Potential Uses
Natural Occurrence
Synonyms
dipropyl carbinol
dipropylcarbinol
heptan-4-ol
4-
hydroxyheptane
PubMed:
Preparation of polypyrrole composite solid-phase microextraction fiber coatings by sol-gel technique for the trace analysis of polar biological volatile organic compounds.
PubMed:
Effect of the addition of alkanols of different topology to dipalmitoyl-phosphatidylcholine vesicles in the presence of gramicidin.
PubMed:
Intensely luminescent homoleptic alkynyl decanuclear gold(I) clusters and their cationic octanuclear phosphine derivatives.
PubMed:
New cysteine-S-conjugate precursors of volatile sulfur compounds in bell peppers (Capsicum annuum L. cultivar).
PubMed:
Fragrance material review on 2,6-dimethyl-4-heptanol.
PubMed:
Separation, synthesis and estrogenic activity of 4-nonylphenols: two sets of new diastereomeric isomers in a commercial mixture.
PubMed:
Exocrine chemistry of the myrmicine ant Zacryptocerus pusillus (Hymenoptera: Formicidae).
PubMed:
Preparation of single-enantiomer 2-methyl-4-heptanol, a pheromone of Metamasius hemipterus, using (S)-2-methoxy-2-(1-naphthyl)propionic acid.
PubMed:
Creating space for large secondary alcohols by rational redesign of Candida antarctica lipase B.
PubMed:
Evidence for a male-produced aggregation pheromone in Scyphophorus acupunctatus Gyllenhal (Coleoptera: Curculionidae).
PubMed:
Pheromone-based trapping of West Indian sugarcane weevil in a sugarcane plantation.
PubMed:
Solvent effect on ion-pair extraction of 2-(2-pyridylazo)-1-naphthol-4-sulfonate anion with solvated hydroxonium ion using alcohols and 1-octanol/octane mixed solvents.
PubMed:
Optimization of semiochemical-based trapping ofMetamasius hemipterus sericeus (Olivier) (Coleoptera: Curculionidae).
PubMed:
Chemical identification, electrophysiological and behavioral activities of the pheromone of Metamasius hemipterus (Coleoptera: Curculionidae).
PubMed:
In vitro quantitative structure-activity relationship assessment of pyrrole adducts production by gamma-diketone-forming neurotoxic solvents.
PubMed:
4-Spiro[2.n]alkyl cations and their rearrangements.
PubMed:
Identification of the n-heptane metabolites in rat and human urine.
PubMed:
Alphatic 3,4-epoxyalcohols. Metabolism by epoxide hydrase and mutagenic activity.
PubMed:
Purification and characterization of a secondary alcohol dehydrogenase from a pseudomonad.
PubMed:
The specificities and configurations of ternary complexes of yeast and liver alcohol dehydrogenases.