chempirical

2-Cyclohexen-1-ol

C6H10OCAS 822-67-398.15 g/mol

Open in Covalent MOL file
HO
AlcoholAlkene

Properties

Molecular formula
C6H10O
Molar mass
98.15 g/mol
Exact mass
98.0732 Da
Density
1 g/mL (at 28 °C)
Melting point
107–108 °C
Boiling point
164 °C
logP
1.09Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
822-67-3
SMILES
OC1C=CCCC1
InChIKey
PQANGXXSEABURG-UHFFFAOYSA-N
InChI
InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h2,4,6-7H,1,3,5H2

Weigh it out

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

Names and synonyms

9 names
  • Cyclohexen-3-ol
  • 2-Cyclohexenol
  • 3-Hydroxycyclohexene
  • 1-Cyclohexen-3-ol
  • 1-Hydroxy-2-cyclohexene
  • (±)-2-Cyclohexen-1-ol
  • 3-Hydroxy-1-cyclohexene
  • NSC 64656
  • 2-Cyclohexenyl alcohol

Work with 2-Cyclohexen-1-ol

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

2-Hydroxyadipaldehyde141-31-144 % similar 4-Hydroxynonenal29343-52-038 % similar 4-Hydroxynonenal75899-68-238 % similar 1,3-Cyclooctadiene1700-10-335 % similar 1,3-Cyclooctadiene3806-59-535 % similar (±)-1-Hepten-3-ol4938-52-734 % similar Leukotriene B471160-24-234 % similar 1-Octen-3-ol3391-86-433 % similar

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

Same formula

3-Hexyn-1-ol1002-28-4 2-(3-Buten-1-yl)oxirane10353-53-4 1-Hexyn-3-ol105-31-7 Cyclohexanone108-94-1 5-Hexen-2-one109-49-9 3-Hexyn-2-ol109-50-2 2,4-Hexadien-1-ol111-28-4 2-Methylcyclopentanone1120-72-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook