4-methyl octane
octane, 4-methyl- (8CI)(9CI)
Identification
| Name | 4-methyl octane |
| IUPAC | 4-methyloctane |
| CAS Number | 2216-34-4 |
| EINECS | 218-687-2 |
| FDA UNII | Search |
| Molecular Formula | C9 H20 |
| Molecular Weight | 128.25840000 |
| MDL Number | MFCD00039963 |
| Nikkaji Number | J96.505G |
| Beilstein | 1730896 |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 142.40 °C. @ 760.00 mm Hg |
| Vapor Pressure | 6.830000 mmHg @ 25.00 °C. (est) |
| Flash Point | 76.00 °F. TCC ( 24.20 °C. ) (est) |
| logP (o/w) | 5.350 (est) |
| Soluble in | water, 0.115 mg/L @ 25 °C (exp) |
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 | natural substances and extractives |
| Recommendation for 4-methyl octane usage levels up to | not for fragrance use. |
| Recommendation for 4-methyl octane flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
4-
methyloctane
4-iso
nonane
octane, 4-methyl-
octane, 4-methyl- (8CI)(9CI)
PubMed:
Release of volatile organic compounds (VOCs) from the lung cancer cell line CALU-1 in vitro.