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

Name
1-METHYL-3-CYCLOHEXENE-1-METHANOL
EINECS
CAS No. 50552-10-8
Article Data4
CAS DataBase
Density 0.922 g/cm³
Solubility
Melting Point
Formula C₈H₁₄O
Boiling Point 172.6 °C at 760 mmHg
Molecular Weight 126.199
Flash Point 66.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Methyl-3-cyclohexene-1-methanol;1-Methyl-3-cyclohexenemethanol;NSC 97520;
PSA 20.23000
LogP 1.72510

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

Product Name

1-METHYL-3-CYCLOHEXENE-1-METHANOL

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

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