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| CAS No.: | 67801-20-1 |
|---|---|
| Name: | Ebanol |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C14H24O |
| Molecular Weight: | 208.344 |
| Synonyms: | 3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol;3-Methyl-5-(2,2,3-trimethylcyclopent-3-enyl)pent-4-en-2-ol;Ebanol; |
| EINECS: | 267-140-4 |
| Density: | 0.938 g/cm3 |
| Boiling Point: | 287.3 °C at 760 mmHg |
| Flash Point: | 103.5 °C |
| Solubility: | 34mg/L at 20℃ |
| PSA: | 20.23000 |
| LogP: | 4.61090 |
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- Total:25 Page 1 of 1 1
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Specification
The CAS register number of Ebanol is 67801-20-1. It also can be called as 3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)pent-4-en-2-ol and the IUPAC name about this chemical is (Z)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol. The molecular formula about this chemical is C14H24O and the molecular weight is 208.34.
Physical properties about Ebanol are: (1)ACD/LogP: 4.43; (2)ACD/LogD (pH 5.5): 4.43; (3)ACD/LogD (pH 7.4): 4.43; (4)#H bond acceptors: 1; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 4; (7)Polar Surface Area: 20.23Å2; (8)Index of Refraction: 1.522; (9)Molar Refractivity: 67.78 cm3; (10)Molar Volume: 222 cm3; (11)Polarizability: 26.87x10-24cm3; (12)Surface Tension: 34.9 dyne/cm; (13)Enthalpy of Vaporization: 61.1 kJ/mol; (14)Boiling Point: 287.3 °C at 760 mmHg; (15)Vapour Pressure: 0.000281 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(O)C(C)C=CC1C\C=C(\C)C1(C)C
(2)InChI: InChI=1/C14H24O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h6-8,10,12-13,15H,9H2,1-5H3
(3)InChIKey: RNLHVODSMDJCBR-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C14H24O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h6-8,10,12-13,15H,9H2,1-5H3
(5)Std. InChIKey: RNLHVODSMDJCBR-UHFFFAOYSA-N