6-Octen-2-ol,3,7-dimethyl-, 2-acetate supplier

Name
3,7-dimethyloct-6-en-2-yl acetate
EINECS 239-154-0
CAS No. 15103-31-8
Density 0.884 g/cm³
Solubility
Melting Point
Formula C₁₂H₂₂O₂
Boiling Point 253.4 °C at 760 mmHg
Molecular Weight 198.30
Flash Point 84.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Octen-2-ol,3,7-dimethyl-, acetate (6CI,8CI,9CI);2,6-Dimethyloct-2-en-7-ol acetate;Elenylacetate;3,7-Dimethyloct-6-en-2-yl acetate;3,7-Dimethyl-6-octen-2-ol acetate;
PSA 26.30000
LogP 3.32050

6-Octen-2-ol,3,7-dimethyl-, 2-acetate Specification

The 6-Octen-2-ol,3,7-dimethyl-, 2-acetate, with the CAS registry number 15103-31-8, is also known as 3,7-Dimethyl-6-octen-2-ol acetate. Its EINECS number is 239-154-0 and its systematic name is 3,7-Dimethyloct-6-en-2-yl acetate. This chemical's molecular formula is C₁₂H₂₂O₂ and molecular weight is 198.30.

Physical properties of 6-Octen-2-ol,3,7-dimethyl-, 2-acetate are: (1)ACD/LogP: 4.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.16; (4)ACD/LogD (pH 7.4): 4.16; (5)ACD/BCF (pH 5.5): 858.15; (6)ACD/BCF (pH 7.4): 858.15; (7)ACD/KOC (pH 5.5): 4379.72; (8)ACD/KOC (pH 7.4): 4379.72; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.441; (14)Molar Refractivity: 59.23 cm³; (15)Molar Volume: 224.2 cm³; (16)Polarizability: 23.48×10^-24cm³; (17)Surface Tension: 27.2 dyne/cm; (18)Density: 0.884 g/cm³; (19)Flash Point: 84.7 °C; (20)Enthalpy of Vaporization: 49.08 kJ/mol; (21)Boiling Point: 253.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0183 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C(CC\C=C(/C)C)C)C)C
(2)InChI: InChI=1S/C12H22O2/c1-9(2)7-6-8-10(3)11(4)14-12(5)13/h7,10-11H,6,8H2,1-5H3
(3)InChIKey: ZUFHJEXSOHWOKU-UHFFFAOYSA-N

Product Name

3,7-dimethyloct-6-en-2-yl acetate

6-Octen-2-ol,3,7-dimethyl-, 2-acetate Specification

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