4-Ethylcyclohexanol

C8H16OCAS 4534-74-1128.21 g/mol

Open in Covalent MOL file
OH
Alcohol

Properties

Molecular formula
C8H16O
Molar mass
128.21 g/mol
Exact mass
128.1201 Da
Density
0.9194 g/mL (at 21 °C)
Melting point
194–196 °C
Boiling point
191–192 °C
logP
1.95Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number
4534-74-1
SMILES
CCC1CCC(O)CC1
InChIKey
RVTKUJWGFBADIN-UHFFFAOYSA-N
InChI
InChI=1S/C8H16O/c1-2-7-3-5-8(9)6-4-7/h7-9H,2-6H2,1H3

Weigh it out

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

Names and synonyms

3 names
  • Cyclohexanol, 4-ethyl-
  • NSC 21118
  • 4-Ethylcyclohexan-1-ol

Work with 4-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

(3R,6R)-3,6-Octanediol129619-37-063 % similar 4-Propylcyclohexanol52204-65-659 % similar 7-Ethyl-2-methyl-4-undecanol103-20-853 % similar Cyclopropanol16545-68-953 % similar 1,4-Cyclohexanediol556-48-953 % similar trans-1,4-Cyclohexanediol6995-79-553 % similar 3-Pentanol584-02-153 % similar (Trans,trans)-4′-Propyl[1,1′-bicyclohexyl]-4-ol82832-72-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Octanone106-68-3 2-Octanone111-13-7 1-Cyclohexylethanol1193-81-3 2-Ethylhexanal123-05-7 Octanal124-13-0 2-Methyl-3-heptanone13019-20-0 2,2,5,5-Tetramethyltetrahydrofuran15045-43-9 (E)-2-Octen-1-ol18409-17-1

Elsewhere

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