Phenol,2-methyl-4-(1-phenylethyl)- supplier

Name
4-(1-phenylethyl)-o-cresol
EINECS 254-171-3
CAS No. 38875-47-7
Article Data10
CAS DataBase
Density 1.057 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₆O
Boiling Point 328.9 °C at 760 mmHg
Molecular Weight 212.291
Flash Point 155.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms o-Cresol,4-(a-methylbenzyl)- (6CI);2-Methyl-4-(a-methylbenzyl)phenol;2-Methyl-4-(1-phenylethyl)phenol;4-(1-Phenylethyl)-o-cresol;
PSA 20.23000
LogP 3.85240

Phenol,2-methyl-4-(1-phenylethyl)- Specification

The Phenol,2-methyl-4-(1-phenylethyl)-, with the CAS registry number 38875-47-7, is also known as 4-(1-Phenylethyl)-o-cresol. This chemical's molecular formula is C₁₅H₁₆O and molecular weight is 212.29. What's more, its systematic name is 2-Methyl-4-(1-phenylethyl)phenol and its EINECS number is 254-171-3.

Physical properties of Phenol,2-methyl-4-(1-phenylethyl)- are: (1)ACD/LogP: 4.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.28; (4)ACD/LogD (pH 7.4): 4.28; (5)ACD/BCF (pH 5.5): 1050.53; (6)ACD/BCF (pH 7.4): 1049.53; (7)ACD/KOC (pH 5.5): 5062.02; (8)ACD/KOC (pH 7.4): 5057.16; (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: 1.58; (14)Molar Refractivity: 66.9 cm³; (15)Molar Volume: 200.7 cm³; (16)Polarizability: 26.52×10^-24cm³; (17)Surface Tension: 41.4 dyne/cm; (18)Density: 1.057 g/cm³; (19)Flash Point: 155.3 °C; (20)Enthalpy of Vaporization: 59.41 kJ/mol; (21)Boiling Point: 328.9 °C at 760 mmHg; (22)Vapour Pressure: 9.58E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C=CC(=C1)C(C)C2=CC=CC=C2)O
(2)InChI: InChI=1S/C15H16O/c1-11-10-14(8-9-15(11)16)12(2)13-6-4-3-5-7-13/h3-10,12,16H,1-2H3
(3)InChIKey: JNDJWNJPQORYBX-UHFFFAOYSA-N

Product Name

4-(1-phenylethyl)-o-cresol

Phenol,2-methyl-4-(1-phenylethyl)- Specification

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