n-Benzyl-2,5-dimethoxyaniline
Basic information
- CAS
5338-39-6- Standard SMILES
COc1ccc(OC)c(NCc2ccccc2)c1- InChIKey
OHKDMYGHPZFZDG-UHFFFAOYSA-N- Molecular formula
- C15H17NO2
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.12592879
Names & identifiers
- Preferred name
- n-Benzyl-2,5-dimethoxyaniline
- IUPAC
- N-benzyl-2,5-dimethoxyaniline
Names & synonyms
n-benzyl-2,5-dimethoxyaniline5338-39-6NSC3155Oprea1_073803SCHEMBL30691740DTXSID00277614NSC-3155AKOS000234112SB80901Benzenemethanamine, N-(2,5-dimethoxyphenyl)-
Database identifiers
- CAS
5338-39-6- PubChem CID
- 220418
- DTXSID
DTXSID00277614
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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