2-Methylpentan-3-ol
Properties
- Molecular formula
- C6H14O
- Molar mass
- 102.18 g/mol
- Exact mass
- 102.1045 Da
- Density
- 0.823 g/mL (at 20 °C)
- Boiling point
- 126.5 °C
- logP
- 1.41Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H226 Flammable liquid and vapor100% of notifiers
Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501
Identifiers
CAS number
565-67-3SMILES
CCC(O)C(C)CInChIKey
ISTJMQSHILQAEC-UHFFFAOYSA-NInChI
InChI=1S/C6H14O/c1-4-6(7)5(2)3/h5-7H,4H2,1-3H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- 2-Methyl-3-pentanol
- 3-Pentanol, 2-methyl-
- 4-Methyl-3-pentanol
- 2-Methyl-3-pentyl alcohol
- DL-4-Methylpentan-3-ol
- (±)-2-Methyl-3-pentanol
- (±)-4-Methyl-3-pentanol
- 1-Ethyl-2-methylpropyl alcohol
Work with 2-Methylpentan-3-ol
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
2-Methyl-3-hexanol617-29-857 % similar
4-Ethyl-3-hexanol19780-44-055 % similar
2,5-Dimethyl-3-hexanol19550-07-350 % similar
3-Ethyl-2-methylpentane609-26-745 % similar
(-)-2-Butanol14898-79-443 % similar
(+-)-2-Butanol15892-23-643 % similar
(+)-2-Butanol4221-99-243 % similar
2,3-Dimethylpentane565-59-343 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds