2-Methyl-1,4-pentadiene
Properties
- Molecular formula
- C6H10
- Molar mass
- 82.15 g/mol
- Exact mass
- 82.0783 Da
- Density
- 0.6932 g/mL (at 20 °C)
- Boiling point
- 56 °C
- logP
- 2.14Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Identifiers
CAS number
763-30-4SMILES
C=CCC(=C)CInChIKey
DRWYRROCDFQZQF-UHFFFAOYSA-NInChI
InChI=1S/C6H10/c1-4-5-6(2)3/h4H,1-2,5H2,3H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
1 names
- 1,4-Pentadiene, 2-methyl-
Work with 2-Methyl-1,4-pentadiene
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
2-Methyl-1-butene563-46-241 % similar
Methallyl bromide1458-98-639 % similar
Methallyl alcohol513-42-839 % similar
Methallyl chloride563-47-339 % similar
2-Methyl-1-pentene763-29-138 % similar
Methallyltrimethylsilane18292-38-136 % similar
2,4-Dimethyl-1-pentene2213-32-336 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds