Oxane-4-carboxylic acid
Properties
- Molecular formula
- C6H10O3
- Molar mass
- 130.14 g/mol
- Exact mass
- 130.0630 Da
- logP
- 0.50Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H302 Harmful if swallowed89.1% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage87% of notifiers
- H319 Causes serious eye irritation13% of notifiers
- H335 May cause respiratory irritation95.7% 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+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
5337-03-1SMILES
C1COCCC1C(=O)OInChIKey
AVPKHOTUOHDTLW-UHFFFAOYSA-NInChI
InChI=1S/C6H10O3/c7-6(8)5-1-3-9-4-2-5/h5H,1-4H2,(H,7,8)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Tetrahydro-2H-pyran-4-carboxylic acid
Work with Oxane-4-carboxylic acid
Similar compounds
(R)-Tetrahydrofuran-3-carboxylic acid66838-42-475 % similar
(R)-Tetrahydro-3-furoic acid89364-31-875 % similar
1,4-Cyclohexanedicarboxylic acid1076-97-767 % similar
Cyclopropanecarboxylic acid1759-53-167 % similar
1,4-Cyclohexanedicarboxylic acid619-81-867 % similar
trans-1,4-Cyclohexanedicarboxylic acid619-82-967 % similar
Cyclopentanecarboxylic acid3400-45-161 % similar
Cyclobutanecarboxylic acid3721-95-761 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.