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Cas Database |
| Name |
1-Phenyl-2-propen-1-one |
EINECS | 212-190-4 |
| CAS No. | 768-03-6 | Density | 0.996 g/cm3 |
| PSA | 17.07000 | LogP | 2.05530 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C9H8O | Boiling Point | 202.6 °C at 760 mmHg |
| Molecular Weight | 132.162 | Flash Point | 73.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
3-Oxo-3-phenylpropene;Benzoylethylene;NSC 174109;Phenyl vinyl ketone;Vinylphenyl ketone;Acrylophenone(6CI,8CI);2-Methyleneacetophenone; |
Article Data | 343 |
1-Phenyl-2-propen-1-one Chemical Properties
Molecular Structure of 2-Propenophenone (768-03-6):
EINECS: 212-190-4
IUPAC Name of 2-Propenophenone (768-03-6): 1-Phenylprop-2-en-1-one
Molecular Formula: C9H8O
Molecular Weight: 132.159220 g/mol
XLogP3:1.9
H-Bond Donor: 0
H-Bond Acceptor: 1
Canonical SMILES: C=CC(=O)C1=CC=CC=C1
InChI: InChI=1S/C9H8O/c1-2-9(10)8-6-4-3-5-7-8/h2-7H,1H2
InChIKey: KUIZKZHDMPERHR-UHFFFAOYSA-N
Index of Refraction: 1.525
Molar Refractivity: 40.63 cm3
Molar Volume: 132.5 cm3
Surface Tension: 34.4 dyne/cm
Density: 0.996 g/cm3
Flash Point: 73.7 °C
Enthalpy of Vaporization: 43.88 kJ/mol
Boiling Point: 202.6 °C at 760 mmHg
Vapour Pressure: 0.29 mmHg at 25 °C
Water Solubility: 2236 mg/L at 25 °C
BRN: 0635987
1-Phenyl-2-propen-1-one Toxicity Data With Reference
| 1. | ipr-mus LD50:26 mg/kg | JPCEAO Journal fuer Praktische Chemie. (Johann Ambrosius Barth Verlag, Postfach 109, DDR-701, Leipzig, Germany) V.1- 1834- 325 (1983),55. |
1-Phenyl-2-propen-1-one Safety Profile
A poison by intraperitoneal route. Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes. See also KETONES.
1-Phenyl-2-propen-1-one Standards and Recommendations
DOT Classification: 3; Label: Flammable Liquid
1-Phenyl-2-propen-1-one Specification
2-Propenophenone (768-03-6) is known as 3-Oxo-3-phenylpropene ; 4-07-00-00995 (Beilstein Handbook Reference) ; Acetophenone, 2-methylene- ; Acrylophenone ; Ethylene, benzoyl- ; Ketone, phenyl vinyl ; NSC 174109 ; Phenyl vinyl ketone ; Phenylvinyl ketone ; Phenylvinylketone ; Vinyl phenyl ketone ; 1-Phenyl-2-propen-1-one ; 2-Propen-1-one, 1-phenyl- (9CI) ; Acrylophenone (8CI) .
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