2-Bromo-2-chloro-N,N'-dimethylmalonamide
Basic information
- CAS
4568-74-5- Standard SMILES
CNC(=O)C(Cl)(Br)C(=O)NC- InChIKey
LIWSDJKPIBOGBT-UHFFFAOYSA-N- Molecular formula
- C5H8BrClN2O2
- Average molar mass
- 243.48 g/mol
- Monoisotopic mass
- 241.94577
Overview
See also: Propanediamide, 2-bromo-2-chloro-N,N'-dimethyl- (annotation moved to).
Names & identifiers
- Preferred name
- 2-Bromo-2-chloro-N,N'-dimethylmalonamide
- IUPAC
- 2-bromo-2-chloro-N,N'-dimethylpropanediamide
- English name
- 2-bromo-2-chloro-N,N'-dimethylmalonamide
- Molecular formula
- C5H8BrClN2O2
- Molecular weight
- 243.49
Names & synonyms
2-Bromo-2-chloro-N,N'-dimethylmalonamide4568-74-5EINECS 224-948-1DTXSID80196591LIWSDJKPIBOGBT-UHFFFAOYSA-NNS000487022-Bromo-2-chloro-N~1~,N~3~-dimethylpropanediamide2-Bromo-2-chloro-N,N'-dimethylpropanediamidePropanediamide, 2-bromo-2-chloro-N1,N3-dimethyl-
Database identifiers
- CAS
4568-74-5- PubChem CID
- 78323
- DTXSID
DTXSID80196591- EC Number
- 224-948-1
- Nikkaji
- J297.824E
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Boiling point
- 375.2 · 375.2±42.0 °C(Predicted)
- Density
- 1.65 · 1.650±0.06 g/cm3(Predicted)
- pka
- 11.52 · 11.52±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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