Products Categories
CAS No.: | 716-96-1 |
---|---|
Name: | 2-BENZYL-4-METHYLPHENOL |
Article Data: | 26 |
Molecular Structure: | |
Formula: | C14H14O |
Molecular Weight: | 198.265 |
Synonyms: | 2,4-Xylenol,a2-phenyl- (6CI,7CI,8CI);2-Benzyl-4-methylphenol;2-Benzyl-p-cresol;AI 3-70675;NSC 60030; |
EINECS: | 258-225-7 |
Density: | 1.08 g/cm3 |
Boiling Point: | 324.1 °C at 760 mmHg |
Flash Point: | 154 °C |
PSA: | 20.23000 |
LogP: | 3.29140 |
What can I do for you?
Get Best Price
The Phenol,4-methyl-2-(phenylmethyl)-, with the CAS registry number 716-96-1, is also known as 2-Benzyl-p-cresol. This chemical's molecular formula is C14H14O and molecular weight is 198.26. What's more, its systematic name is 2-Benzyl-4-methylphenol.
Physical properties of Phenol,4-methyl-2-(phenylmethyl)- are: (1)ACD/LogP: 3.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.93; (4)ACD/LogD (pH 7.4): 3.93; (5)ACD/BCF (pH 5.5): 572; (6)ACD/BCF (pH 7.4): 571.61; (7)ACD/KOC (pH 5.5): 3275.99; (8)ACD/KOC (pH 7.4): 3273.76; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.593; (14)Molar Refractivity: 62.27 cm3; (15)Molar Volume: 183.5 cm3; (16)Polarizability: 24.68×10-24 cm3; (17)Surface Tension: 43.3 dyne/cm; (18)Density: 1.08 g/cm3; (19)Flash Point: 154 °C; (20)Enthalpy of Vaporization: 58.85 kJ/mol; (21)Boiling Point: 324.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000133 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1Cc2ccccc2)C
(2)InChI: InChI=1/C14H14O/c1-11-7-8-14(15)13(9-11)10-12-5-3-2-4-6-12/h2-9,15H,10H2,1H3
(3)InChIKey: WGIJGSLQJSMKAH-UHFFFAOYSA-N