4-chloro-N,N-bis(ethoxymethyl)aniline
Basic information
- CAS
72198-34-6- Standard SMILES
CCOCN(COCC)c1ccc(Cl)cc1- InChIKey
MZCBPDXQVBRQAG-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO2
- Average molar mass
- 243.73 g/mol
- Monoisotopic mass
- 243.1026065
Names & identifiers
- Preferred name
- 4-chloro-N,N-bis(ethoxymethyl)aniline
- IUPAC
- 4-chloro-N,N-bis(ethoxymethyl)aniline
Names & synonyms
72198-34-64-chloro-N,N-bis(ethoxymethyl)anilineNSC271904Benzenamine,N-bis(ethoxymethyl)-DTXSID30313534NSC-271904
Database identifiers
- CAS
72198-34-6- PubChem CID
- 321384
- DTXSID
DTXSID30313534
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 164
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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