N,N-Bis(2-chloroethyl)-2-(2,4-dichlorophenoxy)acetamide
Basic information
- CAS
54139-56-9- Standard SMILES
O=C(COc1ccc(Cl)cc1Cl)N(CCCl)CCCl- InChIKey
VRCRJTMXDYPDOQ-UHFFFAOYSA-N- Molecular formula
- C12H13Cl4NO2
- Average molar mass
- 345 g/mol
- Monoisotopic mass
- 342.970039
Names & identifiers
- Preferred name
- N,N-Bis(2-chloroethyl)-2-(2,4-dichlorophenoxy)acetamide
- IUPAC
- N,N-bis(2-chloroethyl)-2-(2,4-dichlorophenoxy)acetamide
Names & synonyms
N,N-Bis(2-chloroethyl)-2-(2,4-dichlorophenoxy)acetamide54139-56-9Acetamide, N,N-bis(2-chloroethyl)-2-(2,4-dichlorophenoxy)-DTXSID20202483
Database identifiers
- CAS
54139-56-9- PubChem CID
- 148663
- DTXSID
DTXSID20202483
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 274
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Compound notes
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