CAS No.41678-36-8,TETRAHYDROMYRCENOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	41678-36-8
Name:	TETRAHYDROMYRCENOL

Formula:	C₁₀H₂₂O
Molecular Weight:	156.2652
Synonyms:	Octen-2-ol,3,7-dimethyl-;3,7-Dimethylocten-2-ol;Octen-2-ol, 3,7-dimethyl-;3,7-dimethyloct-1-en-2-ol;Elgenol;
EINECS:	255-492-1
Density:	0.836 g/cm³
Boiling Point:	213 °C at 760 mmHg
Flash Point:	85.2 °C
Hazard Symbols:	Xn
Risk Codes:	52/53
Safety:	61
PSA:	20.23000
LogP:	2.66980

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Specification

The Tetrahydromyrcenol is an organic compound with the formula C₁₀H₂₂O. The IUPAC name of this chemical is 3,7-dimethyloct-1-en-2-ol. With the CAS registry number 41678-36-8, it is also named as 1-octen-2-ol, 3,7-dimethyl-.

Physical properties about Tetrahydromyrcenol are: (1)ACD/LogP: 4.17; (2)ACD/LogD (pH 5.5): 4.17; (3)ACD/LogD (pH 7.4): 4.17; (4)ACD/BCF (pH 5.5): 865.16; (5)ACD/BCF (pH 7.4): 864.88; (6)ACD/KOC (pH 5.5): 4405.27; (7)ACD/KOC (pH 7.4): 4403.85; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 9.23 Å²; (12)Index of Refraction: 1.441; (13)Molar Refractivity: 49.39 cm³; (14)Molar Volume: 186.7 cm³; (15)Polarizability: 19.58×10^-24cm³; (16)Surface Tension: 27.2 dyne/cm; (17)Density: 0.836 g/cm³; (18)Flash Point: 85.2 °C; (19)Enthalpy of Vaporization: 52.26 kJ/mol; (20)Boiling Point: 213 °C at 760 mmHg; (21)Vapour Pressure: 0.0373 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. When you are using it, avoid release to the environment. Refer to special instructions/safety data sheet.

You can still convert the following datas into molecular structure:
(1)SMILES: O/C(=C)C(CCCC(C)C)C
(2)InChI: InChI=1/C10H20O/c1-8(2)6-5-7-9(3)10(4)11/h8-9,11H,4-7H2,1-3H3
(3)InChIKey: WZRRRLLETLZJGO-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C10H20O/c1-8(2)6-5-7-9(3)10(4)11/h8-9,11H,4-7H2,1-3H3
(5)Std. InChIKey: WZRRRLLETLZJGO-UHFFFAOYSA-N