Phenol,4-methyl-2-(phenylmethyl)- supplier

Name
2-BENZYL-4-METHYLPHENOL
EINECS 258-225-7
CAS No. 716-96-1
Article Data26
CAS DataBase
Density 1.08 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₄O
Boiling Point 324.1 °C at 760 mmHg
Molecular Weight 198.265
Flash Point 154 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,4-Xylenol,a2-phenyl- (6CI,7CI,8CI);2-Benzyl-4-methylphenol;2-Benzyl-p-cresol;AI 3-70675;NSC 60030;
PSA 20.23000
LogP 3.29140

Phenol,4-methyl-2-(phenylmethyl)- Specification

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^-24cm³; (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

Product Name

2-BENZYL-4-METHYLPHENOL

Phenol,4-methyl-2-(phenylmethyl)- Specification

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