4-(2-(3-Methoxyphenyl)ethenyl)aniline
Basic information
- CAS
154028-32-7- Standard SMILES
COc1cccc(C=Cc2ccc(N)cc2)c1- InChIKey
KQIPLUOUWQXDOT-UHFFFAOYSA-N- Molecular formula
- C15H15NO
- Average molar mass
- 225.28 g/mol
- Monoisotopic mass
- 225.1153641
Names & identifiers
- Preferred name
- 4-(2-(3-Methoxyphenyl)ethenyl)aniline
- IUPAC
- 4-[2-(3-methoxyphenyl)ethenyl]aniline
Names & synonyms
4-(2-(3-Methoxyphenyl)ethenyl)anilineSCHEMBL3365675DTXSID201024495
Database identifiers
- CAS
154028-32-7- PubChem CID
- 154674
- DTXSID
DTXSID201024495
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 243
Related reactions
1 records
Compound notes
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