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| CAS No.: | 18479-51-1 |
|---|---|
| Name: | DIHYDROLINALOOL |
| Article Data: | 35 |
| Molecular Structure: | |
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| Formula: | C10H20O |
| Molecular Weight: | 156.268 |
| Synonyms: | 1,2-Dihydrolinalool;2,6-Dimethyl-2-octen-6-ol;3,7-Dimethyl-6-octen-3-ol;3,7-Dimethyl-6-octene-3-ol;Dihydrolinalool;94006-45-8; |
| EINECS: | 242-358-2 |
| Density: | 0.846 g/cm3 |
| Melting Point: | -4.05°C (estimate) |
| Boiling Point: | 223.7 °C at 760 mmHg |
| Flash Point: | 100.5 °C |
| PSA: | 20.23000 |
| LogP: | 2.89380 |
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Specification
The 6-Octen-3-ol,3,7-dimethyl-, with the CAS registry number 18479-51-1, is also known as Dihydrolinalool. It belongs to the product categories of Acyclic Monoterpenes; Biochemistry; Terpenes. Its EINECS registry number is 242-358-2. This chemical's molecular formula is C10H20O and molecular weight is 156.27. Its IUPAC name is called 3,7-dimethyloct-6-en-3-ol.
Physical properties of 6-Octen-3-ol,3,7-dimethyl-: (1)ACD/LogP: 3.32; (2)ACD/LogD (pH 5.5): 3.32; (3)ACD/LogD (pH 7.4): 3.32; (4)ACD/BCF (pH 5.5): 196.81; (5)ACD/BCF (pH 7.4): 196.81; (6)ACD/KOC (pH 5.5): 1526.46; (7)ACD/KOC (pH 7.4): 1526.46; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.451; (12)Molar Refractivity: 49.77 cm3; (13)Molar Volume: 184.5 cm3; (14)Surface Tension: 28.1 dyne/cm; (15)Density: 0.846 g/cm3; (16)Flash Point: 100.5 °C; (17)Enthalpy of Vaporization: 53.5 kJ/mol; (18)Boiling Point: 223.7 °C at 760 mmHg; (19)Vapour Pressure: 0.0192 mmHg at 25°C.
Preparation of 6-Octen-3-ol,3,7-dimethyl-: this chemical can be prepared by 3,7-dimethyl-octa-1,6-dien-3-ol. This reaction will need reagents H2 and Rh(PPh3)3Cl.
Uses of 6-Octen-3-ol,3,7-dimethyl-: it can be used to produce 5-ethyl-5-methyl-dihydro-furan-2-one. This reaction will need reagents KMnO4, CuSO4*5H2O, water and solvent CH2Cl2. The yield is about 72%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC(C)(CCC=C(C)C)O
(2)InChI: InChI=1S/C10H20O/c1-5-10(4,11)8-6-7-9(2)3/h7,11H,5-6,8H2,1-4H3
(3)InChIKey: JRTBBCBDKSRRCY-UHFFFAOYSA-N