Basic information
- CAS
54879-73-1- Standard SMILES
COC(CN=Cc1ccc(Cl)cc1)OC- InChIKey
DYWPRMAUHGGHOQ-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO2
- Average molar mass
- 227.69 g/mol
- Monoisotopic mass
- 227.0713064
Names & identifiers
- Preferred name
- (E)-N-(4-chlorobenzylidene)-2,2-dimethoxyethanamine
- IUPAC
- 1-(4-chlorophenyl)-N-(2,2-dimethoxyethyl)methanimine
Names & synonyms
54879-73-1(E)-N-(4-chlorobenzylidene)-2,2-dimethoxyethanamineDTXSID30494877DB-353545(E)-1-(4-Chlorophenyl)-N-(2,2-dimethoxyethyl)methanimine
Database identifiers
- CAS
54879-73-1- PubChem CID
- 12371743
- DTXSID
DTXSID30494877
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 30.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 187
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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