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[1,1'-Biphenyl]-3-acetamide,N-(phenylmethyl)-

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Name

[1,1'-Biphenyl]-3-acetamide,N-(phenylmethyl)-

EINECS N/A
CAS No. 1131604-78-8 Density 1.113 g/cm3
PSA 32.59000 LogP 5.05280
Solubility N/A Melting Point N/A
Formula C21H19NO Boiling Point 541.895 °C at 760 mmHg
Molecular Weight 301.38 Flash Point 327.539 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1131604-78-8 (N-benzyl-2-(biphenyl-3-yl)acetamide) Hazard Symbols N/A
Synonyms

N-benzyl-2-(biphenyl-3-yl)acetamide;N-benzyl-2-(3-phenylphenyl)acetamide;

 

[1,1'-Biphenyl]-3-acetamide,N-(phenylmethyl)- Specification

This chemical is called [1,1'-Biphenyl]-3-acetamide,N-(phenylmethyl)-, and it can also be named as N-benzyl-2-(biphenyl-3-yl)acetamide. The molecular formula of this chemical is C21H19NO. The CAS registry number of this chemical is 1131604-78-8, and its systematic name is N-benzyl-2-(3-phenylphenyl)acetamide. 

Other characteristics of the [1,1'-Biphenyl]-3-acetamide,N-(phenylmethyl)- can be summarised as followings: (1)ACD/LogP: 4.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.773; (4)ACD/LogD (pH 7.4): 4.773; (5)ACD/BCF (pH 5.5): 2496.028; (6)ACD/BCF (pH 7.4): 2496.029; (7)ACD/KOC (pH 5.5): 9404.743; (8)ACD/KOC (pH 7.4): 9404.748; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 29.1 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 93.139 cm3; (15)Molar Volume: 270.68 cm3; (16)Polarizability: 36.923×10-24 cm3; (17)Surface Tension: 45.287 dyne/cm; (18)Density: 1.113 g/cm3; (19)Flash Point: 327.539 °C; (20)Enthalpy of Vaporization: 81.989 kJ/mol; (21)Boiling Point: 541.895 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: c1ccc(cc1)CNC(=O)Cc2cccc(c2)c3ccccc3
2.InChI: InChI=1/C21H19NO/c23-21(22-16-17-8-3-1-4-9-17)15-18-10-7-13-20(14-18)19-11-5-2-6-12-19/h1-14H,15-16H2,(H,22,23)
3.InChIKey: UDYNMQJNZQEZFC-UHFFFAOYAQ

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