CAS No.75898-35-0,2'-AMINO-BIPHENYL-4-CARBONITRILE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	75898-35-0
Name:	2'-AMINO-BIPHENYL-4-CARBONITRILE
Article Data:	20

Formula:	C₁₃H₁₀N₂
Molecular Weight:	194.236
Synonyms:	2-Amino-4'-cyanobiphenyl;2'-Aminobiphenyl-4-carbonitrile;[1,1'-Biphenyl]-4-carbonitrile, 2'-amino-;
Density:	1.18 g/cm³
Boiling Point:	378.1 °C at 760 mmHg
Flash Point:	182.5 °C
PSA:	49.81000
LogP:	3.38868

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Specification

The [1,1'-Biphenyl]-4-carbonitrile,2'-amino-, with the CAS registry number 75898-35-0, has the systematic name of 2'-aminobiphenyl-4-carbonitrile. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₃H₁₀N₂.

The characteristics of [1,1'-Biphenyl]-4-carbonitrile,2'-amino- are as followings: (1)ACD/LogP: 2.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 19.46; (6)ACD/BCF (pH 7.4): 19.5; (7)ACD/KOC (pH 5.5): 291.15; (8)ACD/KOC (pH 7.4): 291.73; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 27.03 Å²; (13)Index of Refraction: 1.649; (14)Molar Refractivity: 59.64 cm³; (15)Molar Volume: 163.6 cm³; (16)Polarizability: 23.64×10^-24cm³; (17)Surface Tension: 58.7 dyne/cm; (18)Density: 1.18 g/cm³; (19)Flash Point: 182.5 °C; (20)Enthalpy of Vaporization: 62.6 kJ/mol; (21)Boiling Point: 378.1 °C at 760 mmHg; (22)Vapour Pressure: 6.42E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N#Cc1ccc(cc1)c2ccccc2N
(2)InChI: InChI=1/C13H10N2/c14-9-10-5-7-11(8-6-10)12-3-1-2-4-13(12)15/h1-8H,15H2
(3)InChIKey: HOKIEIHVZCGCPS-UHFFFAOYAW