Basic information
- CAS
117048-62-1- Standard SMILES
COc1ccc(C=Cc2cc(OC)c(OC)c(OC)c2)cc1O- InChIKey
HVXBOLULGPECHP-UHFFFAOYSA-N- Molecular formula
- C18H20O5
- Average molar mass
- 316.3 g/mol
- Monoisotopic mass
- 316.13107373
Overview
2-Methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol has been reported in Combretum erythrophyllum and Combretum afrum with data available.
Names & identifiers
- Preferred name
- 2-Methoxy-5-(2-(3,4,5-trimethoxyphenyl)ethenyl)phenol
- IUPAC
- 2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
Names & synonyms
2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol117048-62-1DTXSID502757212-methoxy-5-(2-(3,4,5-trimethoxyphenyl)ethenyl)phenolRefChem:262598DTXCID702271212-methoxy-5-[2-(3,4,5-trimethoxyphenyl)vinyl]phenolCrc 87-09NCIMech_000496Neuro_000235Neuro_000240SCHEMBL18946
Show more names
Phenol, 2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]-CHEMBL2142429SCHEMBL29501750s7783AKOS030228087NCGC00263098-01NCGC00263098-03NCI60_004765
Database identifiers
- CAS
117048-62-1- PubChem CID
- 72686
- DTXSID
DTXSID50275721- ChEMBL
CHEMBL2142429
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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