The 3-Cyclohexene-1-methanol, 6-methyl-, with the CAS registry number 5259-31-4, is also known as (6-Methyl-3-cyclohexen-1-yl)methanol. It belongs to the product categories of Alkenes; Cyclic; Organic Building Blocks. Its EINECS registry number is 226-063-6. This chemical's molecular formula is C8H14O and molecular weight is 126.2. What's more, its IUPAC name is (6-Methylcyclohex-3-en-1-yl)methanol. In addition, it must be stored in airtight containers and placed in a dry, cool place. Meanwhile, it should be kept away from oxidant.
Physical properties about 3-Cyclohexene-1-methanol, 6-methyl- are: (1)ACD/LogP: 2.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.99; (4)ACD/LogD (pH 7.4): 1.99; (5)ACD/BCF (pH 5.5): 19.33; (6)ACD/BCF (pH 7.4): 19.33; (7)ACD/KOC (pH 5.5): 289.9; (8)ACD/KOC (pH 7.4): 289.9; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.464; (14)Molar Refractivity: 38.21 cm3; (15)Molar Volume: 138.3 cm3; (16)Polarizability: 15.14×10-24 cm3; (17)Surface Tension: 33.2 dyne/cm; (18)Density: 0.912 g/cm3; (19)Flash Point: 70.4 °C; (20)Enthalpy of Vaporization: 48.31 kJ/mol; (21)Boiling Point: 178.7 °C at 760 mmHg; (22)Vapour Pressure: 0.292 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: OCC1C/C=C\CC1C
(2) InChI: InChI=1/C8H14O/c1-7-4-2-3-5-8(7)6-9/h2-3,7-9H,4-6H2,1H3
(3) InChIKey: FNCRYRFSEYFWQZ-UHFFFAOYAU
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