1-Cyclopentene-1-carboxylic acid
Properties
- Molecular formula
- C6H8O2
- Molar mass
- 112.13 g/mol
- Exact mass
- 112.0524 Da
- Melting point
- 119 °C
- Boiling point
- 210–215 °C (at 15 Torr)
- logP
- 1.18Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H314 Causes severe skin burns and eye damage13.3% of notifiers
- H315 Causes skin irritation86.7% of notifiers
- H319 Causes serious eye irritation86.7% of notifiers
- H335 May cause respiratory irritation86.7% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501
Identifiers
CAS number
1560-11-8SMILES
O=C(O)C1=CCCC1InChIKey
PYRZPBDTPRQYKG-UHFFFAOYSA-NInChI
InChI=1S/C6H8O2/c7-6(8)5-3-1-2-4-5/h3H,1-2,4H2,(H,7,8)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Isoaleprolic acid
- 1-Cyclopentenecarboxylic acid
- 1-Cyclopentenylcarboxylic acid
- NSC 44968
Work with 1-Cyclopentene-1-carboxylic acid
Similar compounds
1-Cyclohexene-1-carboxylic acid636-82-887 % similar
Arecaidine499-04-745 % similar
Methyl cyclopent-1-ene-1-carboxylate25662-28-645 % similar
1-Acetylcyclohexene932-66-143 % similar
Perillic acid7694-45-339 % similar
Methyl 1-cyclohexene-1-carboxylate18448-47-039 % similar
Oxalic acid144-62-736 % similar
1-Cyclohexene-1-acetic acid18294-87-636 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.