2-Chlorobutanoic acid
Properties
- Molecular formula
- C4H7ClO2
- Molar mass
- 122.55 g/mol
- Exact mass
- 122.0135 Da
- Density
- 1.189 g/mL (at 25 °C)
- Melting point
- 76.2–77 °C
- Boiling point
- 109.5 °C (at 24 Torr)
- logP
- 1.09Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501
Identifiers
CAS number
4170-24-5SMILES
CCC(Cl)C(=O)OInChIKey
RVBUZBPJAGZHSQ-UHFFFAOYSA-NInChI
InChI=1S/C4H7ClO2/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H,6,7)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
12 names
- Butanoic acid, 2-chloro-
- Butyric acid, 2-chloro-
- Butyric acid, α-chloro-
- 2-Chlorobutyric acid
- α-Chlorobutyric acid
- (±)-2-Chlorobutyric acid
- (±)-α-Chlorobutanoic acid
- (±)-2-Chlorobutanoic acid
- (RS)-α-Chlorobutyric acid
- (RS)-2-Chlorobutyric acid
- α-Monochlorobutanoic acid
- 2-Chloro-n-butyric acid
Work with 2-Chlorobutanoic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
2,3-Dichloropropionic acid565-64-058 % similar
(S)-2-Chloro-4-methyl-N-valeric acid28659-81-657 % similar
Ethylmalonic acid601-75-256 % similar
2-Ethylbutanoic acid88-09-556 % similar
(R)-2-Chlorosuccinic acid3972-40-554 % similar
(2S)-2-Chlorobutanedioic acid4198-33-854 % similar
2-Methylbutanoic acid116-53-052 % similar
(+)-2-Methylbutanoic acid1730-91-252 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.