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CAS No.: | 94138-66-6 |
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Name: | alpha-(isopropyl)-gamma,gamma-dimethylcyclohexanepropanol |
Molecular Structure: | |
Formula: | C14H28O |
Molecular Weight: | 212.37152 |
Synonyms: | alpha-(isopropyl)-gamma,gamma-dimethylcyclohexanepropanol;γ,γ-Dimethyl-α-isopropylcyclohexane-1-propanol |
EINECS: | 302-981-3 |
Density: | 0.896 g/cm3 |
Boiling Point: | 264.468 °C at 760 mmHg |
Flash Point: | 116.295 °C |
PSA: | 20.23000 |
LogP: | 3.99990 |
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The Cyclohexanepropanol, gamma,gamma-dimethyl-alpha-(1-methylethyl)-, with the CAS registry number 94138-66-6, is also known as alpha-(Isopropyl)-gamma,gamma-dimethylcyclohexanepropanol. Its EINECS registry number is 302-981-3. This chemical's molecular formula is C14H28O and molecular weight is 212.37152. Its IUPAC name is called 5-cyclohexyl-2,5-dimethylhexan-3-ol.
Physical properties of Cyclohexanepropanol, gamma,gamma-dimethyl-alpha-(1-methylethyl)-: (1)ACD/LogP: 4.79; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.468; (6)Molar Refractivity: 65.849 cm3; (7)Molar Volume: 236.986 cm3; (8)Surface Tension: 33.099 dyne/cm; (9)Density: 0.896 g/cm3; (10)Flash Point: 116.295 °C; (11)Enthalpy of Vaporization: 58.338 kJ/mol; (12)Boiling Point: 264.468 °C at 760 mmHg; (13)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)C(CC(C)(C)C1CCCCC1)O
(2)InChI: InChI=1S/C14H28O/c1-11(2)13(15)10-14(3,4)12-8-6-5-7-9-12/h11-13,15H,5-10H2,1-4H3
(3)InChIKey: BHHSAAAGWSTDGV-UHFFFAOYSA-N