2-Methyl-1-hexene

C₇H₁₄CAS 6094-02-698.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₄
Molar mass: 98.19 g/mol
Exact mass: 98.1096 Da
Density: 0.6987 g/mL (at 25 °C)
Melting point: −102.8 °C
Boiling point: 92 °C
logP: 2.75Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Identifiers

CAS number

6094-02-6

SMILES

C=C(C)CCCC

InChIKey

IRUDSQHLKGNCGF-UHFFFAOYSA-N

InChI

InChI=1S/C7H14/c1-4-5-6-7(2)3/h2,4-6H2,1,3H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

2 names

1-Hexene, 2-methyl-
NSC 73924

Work with 2-Methyl-1-hexene

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-1-heptene15870-10-785 % similar 2-Methyl-1-pentene763-29-170 % similar 2,5-Dimethyl-1,5-hexadiene627-58-758 % similar 2-Ethyl-1-hexene1632-16-254 % similar Isoprenol763-32-646 % similar 2-Methyl-1-butene563-46-245 % similar 2-Hexanone591-78-644 % similar 5-Nonanone502-56-742 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methylcyclohexane-D1410120-28-2 Methylcyclohexane108-87-2 trans-3-Heptene14686-14-7 Ethylcyclopentane1640-89-7 2,4-Dimethyl-1-pentene2213-32-3 1,2-Dimethylcyclopentane2452-99-5 Cycloheptane291-64-5 2,3-Dimethyl-1-pentene3404-72-6

Elsewhere

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