1-Ethylcyclohexanol
Properties
- Molecular formula
- C8H16O
- Molar mass
- 128.22 g/mol
- Exact mass
- 128.1201 Da
- Density
- 0.9226 g/mL (at 25 °C)
- Melting point
- 34.5 °C
- Boiling point
- 166 °C
- logP
- 2.09Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501
Identifiers
CAS number
1940-18-7SMILES
CCC1(O)CCCCC1InChIKey
BUCJHJXFXUZJHL-UHFFFAOYSA-NInChI
InChI=1S/C8H16O/c1-2-8(9)6-4-3-5-7-8/h9H,2-7H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Cyclohexanol, 1-ethyl-
- 1-Ethyl-1-hydroxycyclohexane
- 1-Ethyl-1-cyclohexanol
- NSC 25550
- 1-Hydroxy-1-ethylcyclohexane
Work with 1-Ethylcyclohexanol
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-Ethylcyclopentanol1462-96-094 % similar
3-Ethyl-3-pentanol597-49-961 % similar
3-Ethylhexan-3-ol597-76-255 % similar
1-(Aminomethyl)cyclopentanol45511-81-743 % similar
3-Methyl-3-nonanol21078-72-843 % similar
1-(2-Propen-1-yl)cyclohexanol1123-34-842 % similar
3-Methyl-3-octanol5340-36-339 % similar
1-Methylcyclohexanol590-67-039 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds