Basic information
- CAS
16635-14-6- Standard SMILES
Cc1ccc(C=CC(=O)c2ccccc2O)cc1- InChIKey
OOEWKJHFFYCQBM-UHFFFAOYSA-N- Molecular formula
- C16H14O2
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.09937969
Overview
has antimalarial, antileishmanial, and antioxidant activities; structure in first source
Names & identifiers
- Preferred name
- 1-(2-Hydroxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
- IUPAC
- 1-(2-hydroxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
- English name
- 1-(2-Hydroxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
- Molecular formula
- C16H14O2
- Molecular weight
- 238.28
Names & synonyms
1-(2-hydroxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one2HMC chalconeRefChem:9072291-(2-hydroxyphenyl)-3-(p-tolyl)prop-2-en-1-oneSCHEMBL2807970SCHEMBL30807207OOEWKJHFFYCQBM-UHFFFAOYSA-N2'-HYDROXY-4-METHYLCHALCONE4-Methyl-2'-hydroxychalcone2-Hydroxyphenyl(4-methylstyryl) ketone1-(2-Hydroxyphenyl)-3-(4-methylphenyl)-2-propen-1-one2-Propen-1-one, 1-(2-hydroxyphenyl)-3-(4-methylphenyl)-
Database identifiers
- CAS
16635-14-6- PubChem CID
- 617249
- DTXSID
DTXSID80347021
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 300
Physicochemical properties
- form
- solid
- UNSPSC Code
- 12352200 · 12352200
Chemistry & industry
Suppliers2 total
上海达立康医药科技有限公司18658316824
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
Related reactions
2 records
Compound notes
Loading…