Heptene

C₇H₁₄CAS 592-76-798.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₄
Molar mass: 98.19 g/mol
Exact mass: 98.1096 Da
Density: 0.697 g/mL (at 20 °C)
Melting point: −119.7 °C
Boiling point: 93.6 °C
logP: 2.75Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 4

Identifiers

CAS number

592-76-7

SMILES

C=CCCCCC

InChIKey

ZGEGCLOFRBLKSE-UHFFFAOYSA-N

InChI

InChI=1S/C7H14/c1-3-5-7-6-4-2/h3H,1,4-7H2,2H3

Weigh it out

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

Names and synonyms

4 names

1-Heptene
1-n-Heptene
n-Hept-1-ene
NSC 74130

Work with Heptene

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

1-Octene111-66-094 % similar 1-Dodecene112-41-494 % similar 1-Octadecene112-88-994 % similar 1-Tetradecene1120-36-194 % similar 1-Nonene124-11-894 % similar 1-Pentadecene13360-61-794 % similar 1-Docosene1599-67-394 % similar 1-Nonadecene18435-45-594 % 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

PubChem CAS Common Chemistry NIST WebBook Wikipedia