2-Methyl-3-hexanol
-
2-Methyl-3-hexanol
structure -
-
CAS No:
617-29-8
-
Formula:
C7H16O
-
Chemical Name:
2-Methyl-3-hexanol
-
Synonyms:
3-Hexanol,2-methyl-;2-Methyl-3-hexanol;1-Isopropyl-1-butanol;5-Methyl-4-hexanol;2-Methyl-3-hexyl alcohol;(±)-2-Methyl-3-hexanol;NSC 91501;1-Isopropylbutyl alcohol;100295-82-7
-
CAS No:
Characteristics
20.2
1.80340
0.8303 g/cm3 @ Temp: 11 °C
-30.45°C (estimate)
141 °C
105 °F
n20/D 1.421(lit.)
Flammables area
Safety Information
III
3.2
UN 1987 3/PG 3
3
10
16
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501
H226
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.
2-Methyl-3-hexanol Use and Manufacturing
2-Methyl-3-hexanol can be used as a solvent or as an intermediate in organic synthesis. At room temperature and pressure, or do not decompose products, but flammable. The substance may be harmful to the environment, and special attention should be paid to water bodies. 2-Methyl-3-hexanol is present in mainstream smoke. Seal the container and store it in a sealed main container in a cool, dry place.
Food additives -> Flavoring Agents
Flavoring Agents
Computed Properties
Molecular Weight:116.20
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:116.120115130
Monoisotopic Mass:116.120115130
Topological Polar Surface Area:20.2
Heavy Atom Count:8
Complexity:50.3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes