Cyclohexene oxide
Properties
- Molecular formula
- C6H10O
- Molar mass
- 98.14 g/mol
- Exact mass
- 98.0732 Da
- Density
- 0.967 g/mL (at 25 °C)
- Melting point
- above −10 °C
- Boiling point
- 129–130 °C
- Flash point
- 81 °C
- logP
- 1.33Crippen estimate
- Polar surface area
- 12.5 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H226 Flammable liquid and vapor95.6% of notifiers
- H302 Harmful if swallowed96.2% of notifiers
- H311 Toxic in contact with skin84.8% of notifiers
- H312 Harmful in contact with skin20.9% of notifiers
- H314 Causes severe skin burns and eye damage77.8% of notifiers
- H318 Causes serious eye damage58.9% of notifiers
- H331 Toxic if inhaled72.2% of notifiers
- H341 Suspected of causing genetic defects52.5% of notifiers
Aggregated from 158 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P318, P321, P330, P361+P364, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
286-20-4SMILES
C1CCC2OC2C1InChIKey
ZWAJLVLEBYIOTI-UHFFFAOYSA-NInChI
InChI=1S/C6H10O/c1-2-4-6-5(3-1)7-6/h5-6H,1-4H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
14 names · show all
- 7-Oxabicyclo[4.1.0]heptane
- Cyclohexane, 1,2-epoxy-
- 1,2-Epoxycyclohexane
- 1,2-Cyclohexene oxide
- Cyclohexene epoxide
- Cyclohexylene oxide
- Tetramethyleneoxirane
- Cyclohexane oxide
- cis-1,2-Epoxycyclohexane
- 2,3-Tetramethyleneoxirane
- cis-7-Oxabicyclo[4.1.0]heptane
- cis-Cyclohexene oxide
- NSC 128074
- NSC 5218
Reactions
Work with Cyclohexene oxide
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
Cyclooctene oxide286-62-492 % similar
13-Oxabicyclo[10.1.0]tridecane286-99-792 % similar
Cyclopentene oxide285-67-683 % similar
9-Oxabicyclo[6.1.0]non-4-ene637-90-147 % similar
Dicyclohexano-18-crown-616069-36-642 % similar
3,6-Dioxabicyclo[3.1.0]hexane285-69-838 % similar
cis-Decalin493-01-636 % similar
trans-Decalin493-02-736 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds