4-Pyridinemethanol, alpha-(2-(3,4-dimethoxyphenyl)ethenyl)-
Basic information
- CAS
54313-80-3- Standard SMILES
COc1ccc(/C=C/C(O)c2ccncc2)cc1OC- InChIKey
ZMEBTSCZLMWGGS-HWKANZROSA-N- Molecular formula
- C16H17NO3
- Average molar mass
- 271.31 g/mol
- Monoisotopic mass
- 271.1208434
Names & identifiers
- Preferred name
- 4-Pyridinemethanol, alpha-(2-(3,4-dimethoxyphenyl)ethenyl)-
- IUPAC
- (E)-3-(3,4-dimethoxyphenyl)-1-pyridin-4-ylprop-2-en-1-ol
Names & synonyms
4-Pyridinemethanol, alpha-(2-(3,4-dimethoxyphenyl)ethenyl)-54313-80-3RefChem:1071550BRN 1544334alpha-(2-(3,4-Dimethoxyphenyl)ethenyl)-4-pyridinemethanol5-21-05-00594 (Beilstein Handbook Reference)
Database identifiers
- CAS
54313-80-3- PubChem CID
- 6446009
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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