Basic information
- CAS
1704-15-0- Standard SMILES
O=C(C=C(O)c1ccccc1)c1ccccc1- InChIKey
RZCYUOWKJNUVBF-UHFFFAOYSA-N- Molecular formula
- C15H12O2
- Average molar mass
- 224.25 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxy-1,3-diphenyl-propenone
- IUPAC
- 3-hydroxy-1,3-diphenylprop-2-en-1-one
- English name
- hydroxybenzalaceto-phenone
- Molecular formula
- C15H12O2
- Molecular weight
- 224.26
Names & synonyms
3-Hydroxy-1,3-diphenyl-propenone1704-15-0RefChem:502274659-514-43-hydroxy-1,3-diphenylprop-2-en-1-onehydroxybenzalaceto-phenoneorb3025685SCHEMBL32448023-hydroxy-1 ,3-diphenylprop-2-en-1-onehydroxychalcone2-Benzoyl-1-phenylethene-1-olβ-Phenyl-β-hydroxyacrylophenone
Show more names
1-Hydroxy-1,3-diphenylpropene-3-one1,3-Diphenyl-3-hydroxy-2-propene-1-one3-Hydroxy-1,3-diphenyl-2-propene-1-one2-Propen-1-one, 3-hydroxy-1,3-diphenyl-
Database identifiers
- CAS
1704-15-0- PubChem CID
- 84413
- EC Number
- 659-514-4
Properties
Computed structural properties
- XLogP
- 3.7
- 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
- 281
Physicochemical properties
- Melting point
- 79.8 °C · 79.8°C
- Boiling point
- 325.66 °C · 325.66°C (rough estimate)
- Density
- 1.1139 · 1.1139 (rough estimate)
- refractive index
- 1.66 · 1.6600 (estimate)
- pka
- 8.37 · 8.37±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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