2-Chlorobutanoic acid

C₄H₇ClO₂CAS 4170-24-5122.55 g/mol

Open in Covalent MOL file

Alcohol Carboxylic Acid Halogen

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 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Identifiers

CAS number

4170-24-5

SMILES

CCC(Cl)C(=O)O

InChIKey

RVBUZBPJAGZHSQ-UHFFFAOYSA-N

InChI

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

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Ethyl chloroacetate105-39-5 Isopropyl chloroformate108-23-6 Propyl chloroformate109-61-5 2-Ethoxyacetyl chloride14077-58-8 Methyl 2-chloropropionate17639-93-9 2-(Chloromethyl)-1,3-dioxolane2568-30-1 4-Chlorobutanoic acid627-00-9 (-)-Methyl 2-chloropropionate73246-45-4

Elsewhere

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