2,3-Dimethylpent-1-ene
Properties
- Molecular formula
- C7H14
- Molar mass
- 98.19 g/mol
- Exact mass
- 98.1096 Da
- Density
- 0.7054 g/mL (at 20 °C)
- Melting point
- −134.3 °C
- Boiling point
- 84.3 °C
- logP
- 2.61Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Hazards
Danger
- H225 Highly Flammable liquid and vapor100% of notifiers
- H304 May be fatal if swallowed and enters airways100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P280, P301+P316, P303+P361+P353, P331, P370+P378, P403+P235, P405, P501
Identifiers
CAS number
3404-72-6SMILES
C=C(C)C(C)CCInChIKey
LIMAEKMEXJTSNI-UHFFFAOYSA-NInChI
InChI=1S/C7H14/c1-5-7(4)6(2)3/h7H,2,5H2,1,3-4H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
3 names
- 2,3-Dimethyl-1-pentene
- 1-Pentene, 2,3-dimethyl-
- NSC 74134
Work with 2,3-Dimethylpent-1-ene
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
3-Methylpentan-2-one565-61-748 % similar
2,3-Dimethyl-1-butene563-78-045 % similar
2-Methylbutanoic acid116-53-041 % similar
(+)-2-Methylbutanoic acid1730-91-241 % similar
2-Methylbutanoic acid600-07-741 % similar
(+)-Dihydrocarvone5524-05-041 % similar
(±)-Methyl 2-methylbutanoate868-57-538 % similar
(±)-3-Methyl-2-oxovaleric acid1460-34-037 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.