Hydroxychalcone
Basic information
- CAS
644-78-0- Standard SMILES
O=C(C=Cc1ccccc1O)c1ccccc1- InChIKey
UDOOPSJCRMKSGL-UHFFFAOYSA-N- Molecular formula
- C15H12O2
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.08372962
Names & identifiers
- Preferred name
- Hydroxychalcone
- IUPAC
- 3-(2-hydroxyphenyl)-1-phenylprop-2-en-1-one
- English name
- 2-Hydroxychalcone
- Molecular formula
- C15H12O2
- Molecular weight
- 224.25
Names & synonyms
hydroxychalconeSCHEMBL626787SCHEMBL29420130UDOOPSJCRMKSGL-UHFFFAOYSA-N3-(2-hydroxy-phenyl)-1-phenyl-propenonePD158955PD158956DB-0546683-(2-hydroxyphenyl)-1-phenyl-prop-2-en-1-oneo-Hydroxychalcone2-HYDROXYCHALCONEHYDROXYCHALCONE, 2-
Show more names
2-Hydroxychalcone>SALICYLALACETOPHENONEHYDROXYCHALCONE,2-(AS)TRANS-2-HYDROXYCHALCONE2-Hydroxychalcone, 98+%2-(2-HYDROXYBENZAL)ACETOPHENONE2-Hydroxychalcone, 10 mM in DMSO
Database identifiers
- CAS
644-78-0- PubChem CID
- 97765
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Melting point
- 144 · 144-150 °C(lit.)
- Boiling point
- 396.3 · 396.3±34.0 °C(Predicted)
- Density
- 1.191 · 1.191±0.06 g/cm3(Predicted)
- pka
- 9.26 · 9.26±0.35(Predicted)
- form
- powder
- color
- Yellow
- BRN
- 2049134 · 2049134
- CAS DataBase Reference
- 644 · 644-78-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- hs_code
- 29147000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Description2-hydroxychalcone, a natural flavonoid, is a potent antioxidant, inhibiting lipid peroxidation. It is also capable of inducing apoptosis by downregulating Bcl-2 levels and inhibiting the activation of NF-kB.
Uses2-hydroxychalcone, a natural flavonoid, is a potent antioxidant, inhibiting lipid peroxidation. 2-Hydroxychalcone induces apoptosis by Bcl-2 downregulation. 2-Hydroxychalcone inhibits the activation of NF-kB[1][2][3].
Upstream & downstream products
Upstream raw materials
Related reactions
5 records
Compound notes
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