4,4-Difluorocyclohexanecarboxylic acid
Properties
- Molecular formula
- C7H10F2O2
- Molar mass
- 164.15 g/mol
- Exact mass
- 164.0649 Da
- Melting point
- 105.9 °C
- logP
- 1.90Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation98.7% of notifiers
- H319 Causes serious eye irritation98.7% of notifiers
- H335 May cause respiratory irritation97.4% of notifiers
Aggregated from 76 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
122665-97-8SMILES
O=C(O)C1CCC(F)(F)CC1InChIKey
HYIUDFLDFSIXTR-UHFFFAOYSA-NInChI
InChI=1S/C7H10F2O2/c8-7(9)3-1-5(2-4-7)6(10)11/h5H,1-4H2,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Cyclohexanecarboxylic acid, 4,4-difluoro-
- 4,4-Difluorocyclohexylcarboxylic acid
- 4,4′-Difluorocyclohexanecarboxylic acid
- 4,4-Difluorocyclohexanoic acid
- 4,4-Difluorocyclohexane-1-carboxylic acid
- 4,4-Difluorocyclohexan-1-carboxylic acid
Work with 4,4-Difluorocyclohexanecarboxylic acid
Similar compounds
3,3-Difluorocyclobutanecarboxylic acid107496-54-863 % similar
Cyclopentanecarboxylic acid3400-45-160 % similar
Cyclobutanecarboxylic acid3721-95-760 % similar
1,4-Cyclohexanedicarboxylic acid1076-97-758 % similar
Cyclopropanecarboxylic acid1759-53-158 % similar
1,4-Cyclohexanedicarboxylic acid619-81-858 % similar
trans-1,4-Cyclohexanedicarboxylic acid619-82-958 % similar
Cycloheptanecarboxylic acid1460-16-858 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.