[1,1'-Biphenyl]-2-carbonitrile, 4'-(dimethylamino)- supplier

Name
2-Biphenylcarbonitrile
EINECS
CAS No. 27104-67-2
Article Data3
CAS DataBase
Density 1.11 g/cm³
Solubility
Melting Point 106-107℃ (ligroine ethyl acetate )
Formula C₁₅H₁₄N₂
Boiling Point 403.9 °C at 760 mmHg
Molecular Weight 222.29
Flash Point 179.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Dimethylaminophenyl)benzonitrile;4'-(Dimethylamino)biphenyl-2-carbonitrile;4'-(Dimethylamino)-1,1'-biphenyl-2-carbonitrile;
PSA 23.79000
LogP 3.22528

[1,1'-Biphenyl]-2-carbonitrile, 4'-(dimethylamino)- Specification

The [1,1'-Biphenyl]-2-carbonitrile, 4'-(dimethylamino)-, with the CAS registry number 27104-67-2, is also known as 4'-(Dimethylamino)biphenyl-2-carbonitrile. This chemical's molecular formula is C₁₅H₁₄N₂ and molecular weight is 222.29. What's more, its systematic name is 2-(4-dimethylaminophenyl)benzonitrile.

Physical properties of [1,1'-Biphenyl]-2-carbonitrile, 4'-(dimethylamino)- are: (1)ACD/LogP: 3.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.57; (4)ACD/LogD (pH 7.4): 3.6; (5)ACD/BCF (pH 5.5): 300.53; (6)ACD/BCF (pH 7.4): 320.08; (7)ACD/KOC (pH 5.5): 2029.57; (8)ACD/KOC (pH 7.4): 2161.54; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 27.03 Å²; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 69.16 cm³; (15)Molar Volume: 199 cm³; (16)Polarizability: 27.41×10^-24cm³; (17)Surface Tension: 50.1 dyne/cm; (18)Density: 1.11 g/cm³; (19)Flash Point: 179.8 °C; (20)Enthalpy of Vaporization: 65.52 kJ/mol; (21)Boiling Point: 403.9 °C at 760 mmHg; (22)Vapour Pressure: 9.87E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CN(C)c1ccc(cc1)c2ccccc2C#N
(2)InChI: InChI=1S/C15H14N2/c1-17(2)14-9-7-12(8-10-14)15-6-4-3-5-13(15)11-16/h3-10H,1-2H3
(3)InChIKey: LJGRGXHTZSFRRM-UHFFFAOYSA-N

Product Name

2-Biphenylcarbonitrile

[1,1'-Biphenyl]-2-carbonitrile, 4'-(dimethylamino)- Specification

Related Products

Hot Products