2,5-Dichloro-n,n-diethylaniline
Basic information
- CAS
55039-57-1- Standard SMILES
CCN(CC)c1cc(Cl)ccc1Cl- InChIKey
PMRVKZFUORHRMA-UHFFFAOYSA-N- Molecular formula
- C10H13Cl2N
- Average molar mass
- 218.12 g/mol
- Monoisotopic mass
- 217.0425048
Names & identifiers
- Preferred name
- 2,5-Dichloro-n,n-diethylaniline
- IUPAC
- 2,5-dichloro-N,N-diethylaniline
Names & synonyms
55039-57-12,5-dichloro-n,n-diethylanilineNSC151987DTXSID00970395NSC-151987
Database identifiers
- CAS
55039-57-1- PubChem CID
- 289749
- DTXSID
DTXSID00970395
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 148
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Compound notes
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