chempirical

Ethylcyclohexane

C8H16CAS 1678-91-7112.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C8H16
Molar mass
112.22 g/mol
Exact mass
112.1252 Da
Density
0.784 g/mL (at 20 °C)
Melting point
−111.3 °C
Boiling point
131.9 °C
logP
2.98Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
1678-91-7
SMILES
CCC1CCCCC1
InChIKey
IIEWJVIFRVWJOD-UHFFFAOYSA-N
InChI
InChI=1S/C8H16/c1-2-8-6-4-3-5-7-8/h8H,2-7H2,1H3

Weigh it out

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

Names and synonyms

4 names
  • Cyclohexane, ethyl-
  • NSC 8880
  • Swaclean ECH
  • Cyclohexylethane

Work with Ethylcyclohexane

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

Ethylcyclopentane1640-89-793 % similar Propylcyclohexane1678-92-853 % similar Butylcyclohexane1678-93-953 % similar Pentylcyclohexane4292-92-653 % similar Heptylcyclohexane5617-41-453 % similar Di(2-ethylhexyl)ether10143-60-950 % similar 4-Ethylcyclohexanol4534-74-148 % similar Butylcyclopentane2040-95-147 % similar

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

Same formula

2,4,4-Trimethyl-1-pentene107-39-1 2,4,4-Trimethyl-2-pentene107-40-4 Isooctene11071-47-9 1-Octene111-66-0 2-Octene111-67-1 trans-2-Octene13389-42-9 trans-4-Octene14850-23-8 trans-3-Octene14919-01-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook