Hymebean
Basic information
- CAS
3117-63-3- Standard SMILES
COc1cccc(C=Nc2ccccc2)c1O- InChIKey
FGQNBFMLKYWNIA-UHFFFAOYSA-N- Molecular formula
- C14H13NO2
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.09462866
Names & identifiers
- Preferred name
- Hymebean
- IUPAC
- 2-methoxy-6-(phenyliminomethyl)phenol
- English name
- N-(2-hydroxy-3-methoxybenzylidene)aniline
- Molecular formula
- C14H13NO2
- Molecular weight
- 227.26
Names & synonyms
Hymebean2-methoxy-6-[(E)-(phenylimino)methyl]phenol2-methoxy-6-(phenyliminomethyl)phenol3117-63-3623150-86-72-ImPh-6-MePhenolSCHEMBL14337416MFCD00434335STK9003382-Hydroxy-3-methoxy-benzyliden-anilinAKOS005648474BS-10552
Show more names
(3-methoxy-N-salicylidene)anilinePhenol, 2-methoxy-6-[(phenylimino)methyl]-
N-(2-Hydroxy-3-methoxybenzylidene)aniline6-Methoxy-2-[(E)-phenyliminomethyl]phenolPhenol, 2-methoxy-6-((phenylimino)methyl)-(e)-2-methoxy-6-((phenylimino)methyl)phenol
Database identifiers
- CAS
3117-63-3- PubChem CID
- 193369
- Nikkaji
- J3.439.724D、J735.365K
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Melting point
- 178 °C · 178 °C
- Boiling point
- 376.714 · 376.714±32.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.09 · 1.090±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 8.335 · 8.335±0.35(predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…