Methyl 1-cyclohexene-1-carboxylate
Properties
- Molecular formula
- C8H12O2
- Molar mass
- 140.18 g/mol
- Exact mass
- 140.0837 Da
- Boiling point
- 105 °C (at 40 Torr)
- logP
- 1.66Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H227 Combustible liquid100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, P501
Identifiers
CAS number
18448-47-0SMILES
COC(=O)C1=CCCCC1InChIKey
KXPWRCPEMHIZGU-UHFFFAOYSA-NInChI
InChI=1S/C8H12O2/c1-10-8(9)7-5-3-2-4-6-7/h5H,2-4,6H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 1-Cyclohexene-1-carboxylic acid, methyl ester
- 1-(Methoxycarbonyl)-1-cyclohexene
- 1-(Carbomethoxy)cyclohexene
- Methyl 1-cyclohexenecarboxylate
- Methyl cyclohex-1-ene-1-carboxylate
Work with Methyl 1-cyclohexene-1-carboxylate
Similar compounds
Methyl cyclopent-1-ene-1-carboxylate25662-28-688 % similar
1-Acetylcyclohexene932-66-152 % similar
Arecoline63-75-250 % similar
1-Methoxycyclohexene931-57-750 % similar
1-Cyclohexene-1-carboxylic acid636-82-847 % similar
Arecoline hydrobromide300-08-346 % similar
Dimethyladipate627-93-045 % similar
2,5-Dihydro-3-thiophenecarboxylic acid methyl ester 1,1-dioxide67488-50-044 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.