2,4-Dimethyl-1-pentene
Properties
- Molecular formula
- C7H14
- Molar mass
- 98.19 g/mol
- Exact mass
- 98.1096 Da
- Density
- 0.6937 g/mL (at 20 °C)
- Melting point
- −124.1 °C
- Boiling point
- 81.6 °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 airways88.6% of notifiers
Aggregated from 44 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
2213-32-3SMILES
C=C(C)CC(C)CInChIKey
LXQPBCHJNIOMQU-UHFFFAOYSA-NInChI
InChI=1S/C7H14/c1-6(2)5-7(3)4/h7H,1,5H2,2-4H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
3 names
- 1-Pentene, 2,4-dimethyl-
- NSC 74135
- 2,4-Dimethylpent-1-ene
Work with 2,4-Dimethyl-1-pentene
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
2,5-Dimethyl-1,5-hexadiene627-58-745 % similar
Methyl isobutyl ketone108-10-142 % similar
2-Methyl-1-butene563-46-241 % similar
Isobutyl ketone108-83-839 % similar
Methallyl bromide1458-98-639 % similar
Methallyl alcohol513-42-839 % similar
Methallyl chloride563-47-339 % similar
2-Methyl-1-pentene763-29-138 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.