Cyclopentyl methyl ether
Properties
- Molecular formula
- C6H12O
- Molar mass
- 100.16 g/mol
- Exact mass
- 100.0888 Da
- Boiling point
- 105.44 °C
- logP
- 1.58Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H225 Highly Flammable liquid and vapor100% of notifiers
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin32.2% of notifiers
- H315 Causes skin irritation62.6% of notifiers
- H319 Causes serious eye irritation95.7% of notifiers
Aggregated from 115 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P302+P352, P303+P361+P353, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, P501
Identifiers
CAS number
5614-37-9SMILES
COC1CCCC1InChIKey
SKTCDJAMAYNROS-UHFFFAOYSA-NInChI
InChI=1S/C6H12O/c1-7-6-4-2-3-5-6/h6H,2-5H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Cyclopentane, methoxy-
- Ether, cyclopentyl methyl
- Methoxycyclopentane
- Methyl cyclopentyl ether
- CPME
Work with Cyclopentyl methyl ether
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
4-Methoxypiperidine4045-24-355 % similar
3-Methoxypiperidine4045-29-852 % similar
4-Methoxypiperidine hydrochloride4045-25-448 % similar
3-Methoxy-azetidine110925-17-245 % similar
(Trans,trans)-4-Methoxy-4′-propyl-1,1′-bicyclohexyl97398-80-642 % similar
1,2:7,8-Diepoxyoctane2426-07-542 % similar
1,1-Dimethoxyoctane10022-28-342 % similar
1,1-Dimethoxydecane7779-41-142 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.