Benzoic acid, 4-(2-phenylethyl)- supplier

Name
4-PHENYL ETHYL BENZOIC ACID
EINECS
CAS No. 785-79-5
Article Data7
CAS DataBase
Density 1.082 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₄O₂
Boiling Point 351.4 °C at 760 mmHg
Molecular Weight 226.275
Flash Point 159.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [1,1'-Biphenyl]-4-carboxylic acid, ethyl ester;Ethyl 4-phenylbenzoate;
PSA 37.30000
LogP 3.17000

Benzoic acid, 4-(2-phenylethyl)- Specification

The Benzoic acid, 4-(2-phenylethyl)-, with the CAS registry number 785-79-5, is also known as [1,1'-Biphenyl]-4-carboxylic acid, ethyl ester and Ethyl 4-phenylbenzoate. This chemical's molecular formula is C₁₅H₁₄O₂ and molecular weight is 226.2705. What's more, its systematic name is called Ethyl 4-phenylbenzoate.

Physical properties about Benzoic acid, 4-(2-phenylethyl)- are: (1)ACD/LogP: 4.91; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.556; (8)Molar Refractivity: 67.25 cm³; (9)Molar Volume: 209.1 cm³; (10)Polarizability: 26.66×10^-24 cm³; (11)Surface Tension: 39.8 dyne/cm; (12)Density: 1.082 g/cm³; (13)Flash Point: 159.1 °C; (14)Enthalpy of Vaporization: 59.61 kJ/mol; (15)Boiling Point: 351.4 °C at 760 mmHg; (16)Vapour Pressure: 4.12E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)c2ccc(c1ccccc1)cc2
(2) InChI: InChI=1/C15H14O2/c1-2-17-15(16)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h3-11H,2H2,1H3
(3) InChIKey: FFQZMOHAQYZTNR-UHFFFAOYAF

Product Name

4-PHENYL ETHYL BENZOIC ACID

Benzoic acid, 4-(2-phenylethyl)- Specification

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