Basic information
- CAS
54139-58-1- Standard SMILES
Cc1cc(Cl)ccc1OCC(=O)N(CCCl)CCCl- InChIKey
DUNKYJYNVXOHPE-UHFFFAOYSA-N- Molecular formula
- C13H16Cl3NO2
- Average molar mass
- 324.6 g/mol
- Monoisotopic mass
- 323.024662
Names & identifiers
- Preferred name
- N,N-Bis(2-chloroethyl)-2-(4-chloro-2-methylphenoxy)acetamide
- IUPAC
- N,N-bis(2-chloroethyl)-2-(4-chloro-2-methylphenoxy)acetamide
Names & synonyms
N,N-Bis(2-chloroethyl)-2-(4-chloro-2-methylphenoxy)acetamide54139-58-1DTXSID10969038Acetamide, N,N-bis(2-chloroethyl)-2-(4-chloro-2-methylphenoxy)-
Database identifiers
- CAS
54139-58-1- PubChem CID
- 148665
- DTXSID
DTXSID10969038
Properties
Computed structural properties
- XLogP
- 3.6
- 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
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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