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Tetrahydro-2H-pyran-3-one

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Name

Tetrahydro-2H-pyran-3-one

EINECS 813-813-8
CAS No. 23462-75-1 Density 1.065 g/cm3
PSA 26.30000 LogP 0.36590
Solubility N/A Melting Point N/A
Formula C5H8O2 Boiling Point 176 °C at 760 mmHg
Molecular Weight 100.117 Flash Point 70.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 23462-75-1 (2H-PYRAN-3(4H)-ONE, DIHYDRO-) Hazard Symbols N/A
Synonyms

3-Oxacyclohexanone;Dihydro-2H-pyran-3(4H)-one;Dihydropyran-3-one;Tetrahydro-4H-pyran-3-one;Tetrahydropyran-3-one;

Article Data 24

Tetrahydro-2H-pyran-3-one Specification

The 2H-Pyran-3(4H)-one,dihydro-, with the CAS registry number 23462-75-1, is also known as Dihydro-pyran-3-one. This chemical's molecular formula is C5H8O2 and molecular weight is 100.1158. Its IUPAC name is called oxan-3-one.

Physical properties of 2H-Pyran-3(4H)-one,dihydro-: (1)ACD/LogP: -0.76; (2)ACD/LogD (pH 5.5): -0.76; (3)ACD/LogD (pH 7.4): -0.76; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 9.23; (7)ACD/KOC (pH 7.4): 9.23; (8)#H bond acceptors: 2; (9)Index of Refraction: 1.44; (10)Molar Refractivity: 24.79 cm3; (11)Molar Volume: 93.9 cm3; (12)Surface Tension: 33.4 dyne/cm; (13)Density: 1.065 g/cm3; (14)Flash Point: 70.4 °C; (15)Enthalpy of Vaporization: 41.23 kJ/mol; (16)Boiling Point: 176 °C at 760 mmHg; (17)Vapour Pressure: 1.12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CC(=O)COC1
(2)InChI: InChI=1S/C5H8O2/c6-5-2-1-3-7-4-5/h1-4H2
(3)InChIKey: URUUZIAJVSGYRC-UHFFFAOYSA-N

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