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CAS No.: | 1596-13-0 |
---|---|
Name: | 2-CYCLOHEXYL-5-METHYLPHENOL |
Molecular Structure: | |
Formula: | C13H18O |
Molecular Weight: | 190.285 |
Synonyms: | 6-Cyclohexyl-3-methylphenol;6-Cyclohexyl-m-cresol;3-Hydroxy-4-cyclohexyltoluene;3-Methyl-6-cyclohexylphenol;5-Methyl-2-cyclohexylphenol;m-Cresol,6-cyclohexyl- (6CI,7CI,8CI);2-Cyclohexyl-5-methylphenol; |
Density: | 1.026 g/cm3 |
Melting Point: | 68°C |
Boiling Point: | 261.6 °C at 760 mmHg |
Flash Point: | 119.1 °C |
Appearance: | white like or light brown crystalline powder |
Hazard Symbols: | Xi,N |
Risk Codes: | 36/37/38 |
Safety: | 36/37/39 |
PSA: | 20.23000 |
LogP: | 3.74830 |
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The Phenol,2-cyclohexyl-5-methyl- is an organic compound with the formula C13H18O. The systematic name of this chemical is 2-Cyclohexyl-5-methylphenol. With the CAS registry number 1596-13-0, it is also named as 4-Cyclohexyl-3-hydroxytoluene. Besides, its molecular weight is 190.28.
Physical properties about Phenol,2-cyclohexyl-5-methyl- are: (1)ACD/LogP: 4.46; (2)ACD/LogD (pH 5.5): 4.46; (3)ACD/LogD (pH 7.4): 4.46; (4)ACD/BCF (pH 5.5): 1448.39; (5)ACD/BCF (pH 7.4): 1446.92; (6)ACD/KOC (pH 5.5): 6370.29; (7)ACD/KOC (pH 7.4): 6363.82; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.23 Å2; (12)Index of Refraction: 1.547; (13)Molar Refractivity: 58.82 cm3; (14)Molar Volume: 185.3 cm3; (15)Polarizability: 23.31×10-24 cm3; (16)Surface Tension: 40 dyne/cm; (17)Density: 1.026 g/cm3; (18)Flash Point: 119.1 °C; (19)Enthalpy of Vaporization: 51.95 kJ/mol; (20)Boiling Point: 261.6 °C at 760 mmHg; (21)Vapour Pressure: 0.00703 mmHg at 25 °C.
Preparation: this chemical can be prepared by 3-Methyl-phenol. This reaction will need reagent Aluminium m-cresolate. The reaction time is 12 hours with reaction temperature of 200 °C. The yield is about 47.4%.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C13H18O/c1-10-7-8-12(13(14)9-10)11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
(2)InChIKey: SRGATTGYDONWOU-UHFFFAOYAE
(3)Std. InChI: InChI=1S/C13H18O/c1-10-7-8-12(13(14)9-10)11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
(4)Std. InChIKey: SRGATTGYDONWOU-UHFFFAOYSA-N