Piperazine,1-[1,1'-biphenyl]-4-yl- supplier

Name
1-(4-BIPHENYLYL)-PIPERAZINE
EINECS
CAS No. 180698-19-5
Article Data8
CAS DataBase
Density 1.068 g/cm³
Solubility
Melting Point 142-143°C
Formula C₁₆H₁₈N₂
Boiling Point 422 °C at 760 mmHg
Molecular Weight 238.332
Flash Point 192.2 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 1-(4-Biphenyl)piperazine;1-(Biphenyl-4-yl)piperazine;
PSA 15.27000
LogP 3.15700

Piperazine,1-[1,1'-biphenyl]-4-yl- Specification

This chemical is called Piperazine,1-[1,1'-biphenyl]-4-yl-, and its systematic name is 1-biphenyl-4-ylpiperazine. With the molecular formula of C₁₆H₁₈N₂, its molecular weight is 238.33. The CAS registry number of this chemical is 180698-19-5. Additionally, its product category is Piperazines.

Other characteristics of the Piperazine,1-[1,1'-biphenyl]-4-yl- can be summarised as followings: (1)ACD/LogP: 2.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.08; (4)ACD/LogD (pH 7.4): 1.67; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 5.6; (7)ACD/KOC (pH 5.5): 1.41; (8)ACD/KOC (pH 7.4): 54.41; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.581; (14)Molar Refractivity: 74.39 cm³; (15)Molar Volume: 223 cm³; (16)Polarizability: 29.49×10^-24cm³; (17)Surface Tension: 40 dyne/cm; (18)Density: 1.068 g/cm³; (19)Flash Point: 192.2 °C; (20)Enthalpy of Vaporization: 67.61 kJ/mol; (21)Boiling Point: 422 °C at 760 mmHg; (22)Vapour Pressure: 2.5E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: c1cc(ccc1c2ccccc2)N3CCNCC3
2.InChI: InChI=1/C16H18N2/c1-2-4-14(5-3-1)15-6-8-16(9-7-15)18-12-10-17-11-13-18/h1-9,17H,10-13H2
3.InChIKey: OAKBDDKEEOAXNV-UHFFFAOYAH

Product Name

1-(4-BIPHENYLYL)-PIPERAZINE

Piperazine,1-[1,1'-biphenyl]-4-yl- Specification

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