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Name |
Tetrahydro-2-phenyl-4H-pyran-4-one |
EINECS | N/A |
CAS No. | 147688-62-8 | Density | 1.113 |
PSA | 26.30000 | LogP | 2.10720 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H12 O2 | Boiling Point | 306 ºC |
Molecular Weight | 176.215 | Flash Point | 141 ºC |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-phenyldihydro-2H-pyran-4(3H)-one;4H-Pyran-4-one,tetrahydro-2-phenyl-;Tetrahydro-2-phenyl-4H-pyran-4-one |
Article Data | 5 |
Molecule structure of Tetrahydro-2-phenyl-4H-pyran-4-one (CAS NO.147688-62-8):
IUPAC Name: 2-Phenyloxan-4-one
Molecular Weight: 176.21178 [g/mol]
Molecular Formula: C11H12O2
Index of Refraction: 1.535
Molar Refractivity: 49.239 cm3
Molar Volume: 158.179 cm3
Surface Tension: 40.054 dyne/cm
Density: 1.114 g/cm3
Flash Point: 141.521 °C
Enthalpy of Vaporization: 54.664 kJ/mol
Boiling Point: 306.145 °C at 760 mmHg
Vapour Pressure: 0.001 mmHg at 25 °C
XLogP3-AA: 1.1
H-Bond Acceptor: 2
Rotatable Bond Count: 1
Tautomer Count: 3
Exact Mass: 176.08373
MonoIsotopic Mass: 176.08373
Topological Polar Surface Area: 26.3
Heavy Atom Count: 13
Canonical SMILES: C1COC(CC1=O)C2=CC=CC=C2
InChI: InChI=1S/C11H12O2/c12-10-6-7-13-11(8-10)9-4-2-1-3-5-9/h1-5,11H,6-8H2
InChIKey: WDYWHODSDKVYAL-UHFFFAOYSA-N
Product Categories of Tetrahydro-2-phenyl-4H-pyran-4-one (CAS NO.147688-62-8): API intermediates
Tetrahydro-2-phenyl-4H-pyran-4-one (CAS NO.147688-62-8) is also named as 2-Phenyldihydro-2H-pyran-4(3H)-one ; 2-Phenyltetrahydro-4H-pyran-4-one ; 4H-Pyran-4-one, tetrahydro-2-phenyl- .