2-Chloro-N,N-dimethylacetamide

C₄H₈ClNOCAS 2675-89-0121.56 g/mol

Open in Covalent MOL file

Alkyl halide Amide

Properties

Molecular formula: C₄H₈ClNO
Molar mass: 121.56 g/mol
Exact mass: 121.0294 Da
Melting point: 15–16 °C
Boiling point: 99–101 °C (at 12 Torr)
logP: 0.31Crippen estimate
Polar surface area: 20.3 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed80% of notifiers
H314 Causes severe skin burns and eye damage84% of notifiers
H315 Causes skin irritation16% of notifiers
H319 Causes serious eye irritation16% of notifiers
H335 May cause respiratory irritation12% of notifiers

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

2675-89-0

SMILES

CN(C)C(=O)CCl

InChIKey

XBPPLECAZBTMMK-UHFFFAOYSA-N

InChI

InChI=1S/C4H8ClNO/c1-6(2)4(7)3-5/h3H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

Acetamide, 2-chloro-N,N-dimethyl-
α-Chloro-N,N-dimethylacetamide
N,N-Dimethylchloroacetamide
N,N-Dimethyl-2-chloroacetamide
N,N-Dimethyl-α-chloroacetamide
2-Chloro-N,N′-dimethylacetamide
2-Chlorodimethylacetamide
NSC 1193

Work with 2-Chloro-N,N-dimethylacetamide

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

Similar compounds

N,N-Dimethylpropionamide758-96-355 % similar 2-Amino-N,N-dimethylacetamide1857-19-852 % similar Chloro-N,N-diethylacetamide2315-36-850 % similar 2-Chloro-N-methoxy-N-methylacetamide67442-07-350 % similar N,N-Dimethylbutanamide760-79-250 % similar Dimethylacetoacetamide2044-64-648 % similar 2-Cyano-N,N-dimethylacetamide7391-40-446 % similar 2-Chloro-1-(1-pyrrolidinyl)ethanone20266-00-646 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Aminocyclobutan-1-one hydrochloride1035374-20-9 Pyrrolidin-3-one hydrochloride3760-52-9 N-Ethyl-N-methylcarbamic chloride42252-34-6 N-(2-Chloroethyl)acetamide7355-58-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook