Ethylcyclohexane
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
- Flash point
- 35 °C
- logP
- 2.98Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
Hazards
Danger
- H225 Highly Flammable liquid and vapor97.5% of notifiers
- H304 May be fatal if swallowed and enters airways86.6% of notifiers
- H336 May cause drowsiness or dizziness59.4% of notifiers
Aggregated from 239 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P271, P280, P301+P316, P303+P361+P353, P304+P340, P319, P331, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
1678-91-7SMILES
CCC1CCCCC1InChIKey
IIEWJVIFRVWJOD-UHFFFAOYSA-NInChI
InChI=1S/C8H16/c1-2-8-6-4-3-5-7-8/h8H,2-7H2,1H3Weigh 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
1-Bromo-3-ethylheptane227953-67-550 % similar
1-Ethyl-4-methylcyclohexane3728-56-150 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.