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CAS No.: | 34941-21-4 |
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Name: | 2,2-DIMETHYL-TETRAHYDRO-PYRAN-4-CARBALDEHYDE |
Molecular Structure: | |
Formula: | C8H14O2 |
Molecular Weight: | 142.198 |
Synonyms: | 2, 2-Dimethyltetrahydropyran-4-carboxaldehyde;2, 2-Dimethyltetrahydro-2H-pyran-4-carbaldehyde; |
Density: | 0.998 g/cm3 |
Boiling Point: | 192.271 °C at 760 mmHg |
Flash Point: | 65.16 °C |
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The 2H-Pyran-4-carboxaldehyde, tetrahydro-2, 2-dimethyl-, with the CAS registry number of 34941-21-4, is also known as 2, 2-Dimethyl-tetrahydro-pyran-4-carbaldehyde and 2, 2-Dimethyltetrahydropyran-4-carboxaldehyde. This chemical's molecular formula is C8H14O2 and molecular weight is 142.2. What's more, its systematic name is called 2, 2-Dimethyltetrahydro-2H-pyran-4-carbaldehyde.
Physical properties about 2H-Pyran-4-carboxaldehyde, tetrahydro-2, 2-dimethyl- are: (1)ACD/LogP: 0.90; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.482; (8)Molar Refractivity: 40.594 cm3; (9)Molar Volume: 142.488 cm3; (10)Polarizability: 16.093×10-24 cm3; (11)Surface Tension: 33.47 dyne/cm; (12)Density: 0.998 g/cm3; (13)Flash Point: 65.16 °C; (14)Enthalpy of Vaporization: 42.847 kJ/mol; (15)Boiling Point: 192.271 °C at 760 mmHg; (16)Vapour Pressure: 0.493 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: CC1(C)CC(CCO1)C=O
(2) InChI: InChI=1/C8H14O2/c1-8(2)5-7(6-9)3-4-10-8/h6-7H,3-5H2,1-2H3
(3) InChIKey: LQCOXFCJGIILHS-UHFFFAOYAZ