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Name |
Acetic acid tetrahydro-2H-thiopyran-2-yl ester |
EINECS | N/A |
CAS No. | 14711-62-7 | Density | 1.11 g/cm3 |
PSA | 51.60000 | LogP | 1.79270 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H12O2S | Boiling Point | 225.7 °C at 760 mmHg |
Molecular Weight | 160.23 | Flash Point | 97.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure |
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Hazard Symbols | N/A |
Synonyms |
Acetic Acid Tetrahydro-2H-thiopyran-2-yl Ester;Tetrahydro-2H-thiopyran-2-ol Acetate |
The CAS registry number of Acetic acid tetrahydro-2H-thiopyran-2-yl ester is 14711-62-7. The systematic name is tetrahydrothiopyran-2-yl acetate. In addition, the molecular formula is C7H12O2S and the molecular weight is 160.23. What's more, it should be stored in a cool and dry place.
Physical properties about Acetic acid tetrahydro-2H-thiopyran-2-yl ester are: (1)ACD/LogP: 1.34; (2)ACD/LogD (pH 5.5): 1.34; (3)ACD/LogD (pH 7.4): 1.34; (4)#H bond acceptors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 51.6 Å2; (7)Index of Refraction: 1.499; (8)Molar Refractivity: 42.25 cm3; (9)Molar Volume: 143.9 cm3; (10)Polarizability: 16.75 ×10-24cm3; (11)Surface Tension: 37.7 dyne/cm; (12)Density: 1.11 g/cm3; (13)Flash Point: 97.1 °C; (14)Enthalpy of Vaporization: 46.22 kJ/mol; (15)Boiling Point: 225.7 °C at 760 mmHg; (16)Vapour Pressure: 0.0854 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)OC1CCCCS1
(2)InChI: InChI=1/C7H12O2S/c1-6(8)9-7-4-2-3-5-10-7/h7H,2-5H2,1H3
(3)InChIKey: MFLYPOULZJHAIE-UHFFFAOYAO