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CAS No.: | 19752-84-2 |
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Name: | TETRAHYDRO-PYRAN-3-OL |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C5H10O2 |
Molecular Weight: | 102.133 |
Synonyms: | Pyran-3-ol,tetrahydro- (6CI,7CI);3-Hydroxytetrahydropyran;Tetrahydro-2H-pyran-3-ol; |
Density: | 1.081 g/cm3 |
Boiling Point: | 189.416 °C at 760 mmHg |
Flash Point: | 84.775 °C |
PSA: | 29.46000 |
LogP: | 0.15770 |
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This chemical is called Tetrahydropyran-3-ol, and it can also be named as 2H-pyran-3-ol, tetrahydro-. With the molecular formula of C5H10O2, its molecular weight is 102.13. The CAS registry number of this chemical is 19752-84-2.
Other characteristics of the Tetrahydropyran-3-ol can be summarised as followings: (1)# of Rule of 5 Violations: 0 ; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 14.249; (5)ACD/KOC (pH 7.4): 14.249; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 29.46 Å2; (10)Index of Refraction: 1.468; (11)Molar Refractivity: 26.254 cm3; (12)Molar Volume: 94.484 cm3; (13)Polarizability: 10.408×10-24cm3; (14)Surface Tension: 36.067 dyne/cm; (15)Density: 1.081 g/cm3; (16)Flash Point: 84.775 °C; (17)Enthalpy of Vaporization: 49.534 kJ/mol; (18)Boiling Point: 189.416 °C at 760 mmHg; (19)Vapour Pressure: 0.156 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: C1CC(COC1)O
2.InChI: InChI=1/C5H10O2/c6-5-2-1-3-7-4-5/h5-6H,1-4H2
3.InChIKey: BHDLTOUYJMTTTM-UHFFFAOYAE