3-Oxocyclobutanecarboxylic acid
Properties
- Molecular formula
- C5H6O3
- Molar mass
- 114.10 g/mol
- Exact mass
- 114.0317 Da
- logP
- 0.05Crippen estimate
- Polar surface area
- 54.4 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H302 Harmful if swallowed89.1% of notifiers
- H315 Causes skin irritation93.5% of notifiers
- H318 Causes serious eye damage84.8% of notifiers
- H335 May cause respiratory irritation89.1% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
23761-23-1SMILES
C1C(CC1=O)C(=O)OInChIKey
IENOFRJPUPTEMI-UHFFFAOYSA-NInChI
InChI=1S/C5H6O3/c6-4-1-3(2-4)5(7)8/h3H,1-2H2,(H,7,8)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 3-Oxocyclobutane-1-carboxylic acid
Work with 3-Oxocyclobutanecarboxylic acid
Similar compounds
3,5-Dioxocyclohexanecarboxylic acid42858-60-681 % similar
3-Oxocyclopentanecarboxylic acid98-78-267 % similar
4-Oxo-1,2-cyclopentanedicarboxylic acid1703-61-364 % similar
Propane-1,2,3-tricarboxylic acid99-14-961 % similar
3-Methylenecyclobutanecarboxylic acid15760-36-858 % similar
4-Oxocyclohexanecarboxylic acid874-61-358 % similar
1,4-Cyclohexanedicarboxylic acid1076-97-757 % similar
Cyclopropanecarboxylic acid1759-53-157 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.