1,5-Bis(2-hydroxyphenyl)penta-1,4-dien-3-one
Basic information
- CAS
2150-52-9- Standard SMILES
O=C(/C=C\c1ccccc1O)/C=C/c1ccccc1O- InChIKey
YNVAHBUBGBLIEY-DSOJMZEYSA-N- Molecular formula
- C17H14O3
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.0942943
Names & identifiers
- Preferred name
- 1,5-Bis(2-hydroxyphenyl)penta-1,4-dien-3-one
- IUPAC
- (1Z,4E)-1,5-bis(2-hydroxyphenyl)penta-1,4-dien-3-one
Names & synonyms
EINECS 218-430-4NSC 867162150-52-9RefChem:73430218-430-41,5-bis(2-hydroxyphenyl)penta-1,4-dien-3-oneSCHEMBL1160535
Database identifiers
- CAS
2150-52-9- PubChem CID
- 6436784
- EC Number
- 218-430-4
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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