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3-Cyclohexene-1-methanol,1-methyl-

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Name

3-Cyclohexene-1-methanol,1-methyl-

EINECS N/A
CAS No. 50552-10-8 Density 0.922 g/cm3
PSA 20.23000 LogP 1.72510
Solubility N/A Melting Point N/A
Formula C8H14O Boiling Point 172.6 °C at 760 mmHg
Molecular Weight 126.199 Flash Point 66.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 50552-10-8 (1-METHYL-3-CYCLOHEXENE-1-METHANOL) Hazard Symbols N/A
Synonyms

1-Methyl-3-cyclohexene-1-methanol;1-Methyl-3-cyclohexenemethanol;NSC 97520;

Article Data 4

3-Cyclohexene-1-methanol,1-methyl- Specification

The 3-Cyclohexene-1-methanol, 1-methyl-, with the CAS registry number 50552-10-8, is also known as 1-Methyl-3-cyclohexene-1-methanol. This chemical's molecular formula is C8H14O and molecular weight is 126.2002. What's more, its systematic name is (1-Methylcyclohex-3-en-1-yl)methanol.

Physical properties about 3-Cyclohexene-1-methanol, 1-methyl- are: (1)ACD/LogP: 2.04; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.469; (8)Molar Refractivity: 38.11 cm3; (9)Molar Volume: 136.7 cm3; (10)Polarizability: 15.11×10-24 cm3; (11)Surface Tension: 36.6 dyne/cm; (12)Density: 0.922 g/cm3; (13)Flash Point: 66.4 °C; (14)Enthalpy of Vaporization: 47.62 kJ/mol; (15)Boiling Point: 172.6 °C at 760 mmHg; (16)Vapour Pressure: 0.416 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCC1(C)C/C=C\CC1
(2) InChI: InChI=1/C8H14O/c1-8(7-9)5-3-2-4-6-8/h2-3,9H,4-7H2,1H3
(3) InChIKey: VIOBFIJCQJNINF-UHFFFAOYAD

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