2-Heptene

C₇H₁₄CAS 592-77-898.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₄
Molar mass: 98.19 g/mol
Exact mass: 98.1096 Da
Boiling point: 106–108 °C
logP: 2.75Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Identifiers

CAS number

592-77-8

SMILES

CC=CCCCC

InChIKey

OTTZHAVKAVGASB-UHFFFAOYSA-N

InChI

InChI=1S/C7H14/c1-3-5-7-6-4-2/h3,5H,4,6-7H2,1-2H3

Weigh it out

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

Work with 2-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

cis-2-Heptene6443-92-1100 % similar 2-Octene111-67-183 % similar trans-2-Octene13389-42-983 % similar (2E)-2-Nonene6434-78-279 % similar (5E)-5-Decene7433-56-971 % similar trans-2-Hexene4050-45-767 % similar 2-Hexene592-43-867 % similar 4-Nonene2198-23-463 % 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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