Ethanone,1-(4'-methoxy[1,1'-biphenyl]-4-yl)- supplier

Name
1-(4'-METHOXY-BIPHENYL-4-YL)-ETHANONE
EINECS
CAS No. 13021-18-6
Article Data5
CAS DataBase
Density 1.076g/cm³
Solubility
Melting Point
Formula C₁₅H₁₄O₂
Boiling Point 362.8 °C at 760 mmHg
Molecular Weight 226.275
Flash Point 161.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Acetophenone,4'-(p-methoxyphenyl)- (6CI,7CI,8CI);1-[4-(4-Methoxyphenyl)phenyl]ethanone;4-Acetyl-4'-methoxy-1,1'-biphenyl;4-Acetyl-4'-methoxybiphenyl;4'-(4-Methoxyphenyl)acetophenone;4'-Acetyl-4-methoxybiphenyl;NSC 179420;
PSA 26.30000
LogP 3.56480

Ethanone,1-(4'-methoxy[1,1'-biphenyl]-4-yl)- Specification

The Ethanone,1-(4'-methoxy[1,1'-biphenyl]-4-yl)-, with CAS registry number 13021-18-6, has the systematic name of 1-(4'-methoxybiphenyl-4-yl)ethanone. Besides this, it is also called 1-(4'-Methoxybiphenyl-4-yl)ethan-1-one. And the chemical formula of this chemical is C₁₅H₁₄O₂.

Physical properties of Ethanone,1-(4'-methoxy[1,1'-biphenyl]-4-yl)-: (1)ACD/LogP: 3.33; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.555; (8)Molar Refractivity: 67.55 cm³; (9)Molar Volume: 210.2 cm³; (10)Polarizability: 26.77×10^-24cm³; (11)Surface Tension: 38.1 dyne/cm; (12)Density: 1.076 g/cm³; (13)Flash Point: 161.8 °C; (14)Enthalpy of Vaporization: 60.88 kJ/mol; (15)Boiling Point: 362.8 °C at 760 mmHg; (16)Vapour Pressure: 1.88E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2ccc(c1ccc(OC)cc1)cc2)C
(2)InChI: InChI=1/C15H14O2/c1-11(16)12-3-5-13(6-4-12)14-7-9-15(17-2)10-8-14/h3-10H,1-2H3
(3)InChIKey: AITDOOYSOAAUPM-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C15H14O2/c1-11(16)12-3-5-13(6-4-12)14-7-9-15(17-2)10-8-14/h3-10H,1-2H3
(5)Std. InChIKey: AITDOOYSOAAUPM-UHFFFAOYSA-N

Product Name

1-(4'-METHOXY-BIPHENYL-4-YL)-ETHANONE

Ethanone,1-(4'-methoxy[1,1'-biphenyl]-4-yl)- Specification

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