Dimethylcarbamoyl chloride
Properties
- Molecular formula
- C3H6ClNO
- Molar mass
- 107.54 g/mol
- Exact mass
- 107.0138 Da
- Density
- 1.168 g/mL (at 25 °C)
- Melting point
- −33 °C
- Boiling point
- 167 °C
- Flash point
- 68.3 °C
- logP
- 0.91Crippen estimate
- Polar surface area
- 20.3 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowedAcute toxicity, oral
- H315 Causes skin irritationSkin corrosion/irritation
- H319 Causes serious eye irritationSerious eye damage/eye irritation
- H331 Toxic if inhaledAcute toxicity, inhalation
- H335 May cause respiratory irritationSpecific target organ toxicity, single exposure; Respiratory tract irritation
- H350 May cause cancerCarcinogenicity
Harmonised EU classification (CLP Annex VI), via PubChem.
Precautionary statements
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
79-44-7SMILES
CN(C)C(=O)ClInChIKey
YIIMEMSDCNDGTB-UHFFFAOYSA-NInChI
InChI=1S/C3H6ClNO/c1-5(2)3(4)6/h1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
16 names · show all
- Carbamic chloride, N,N-dimethyl-
- Carbamic chloride, dimethyl-
- Carbamoyl chloride, dimethyl-
- N,N-Dimethylcarbamic chloride
- Dimethylcarbamyl chloride
- N,N-Dimethylcarbamyl chloride
- N,N-Dimethylcarbamoyl chloride
- (Dimethylamino)carbonyl chloride
- Dimethylcarbamic acid chloride
- N,N-Dimethylcarbamidoyl chloride
- (N,N-Dimethylamino)carbonyl chloride
- N,N-Dimethylcarbamic acid chloride
- Dimethylchloroformamide
- N,N-Dimethylchloroformamide
- NSC 122671
- 1-Chloro-N,N-dimethylformamide
Work with Dimethylcarbamoyl chloride
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
N,N-Bis(1-methylethyl)carbamic chloride19009-39-350 % similar
N-Ethyl-N-methylcarbamic chloride42252-34-646 % similar
4-Methyl-1-piperazinecarbonyl chloride39539-66-744 % similar
Diethylcarbamoyl chloride88-10-843 % similar
Tetramethylurea632-22-442 % similar
4-Methyl-1-piperazinecarbonyl chloride hydrochloride55112-42-039 % similar
1-Pyrrolidinecarbonyl chloride1192-63-839 % similar
2-Chloro-N,N-dimethylacetamide2675-89-039 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds