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71195-57-8

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Basic Information
CAS No.: 71195-57-8
Name: Bicifadine
Article Data: 1
Molecular Structure:
Molecular Structure of 71195-57-8 (Bicifadine)
Formula: C12H15 N
Molecular Weight: 173.258
Synonyms: 3-Azabicyclo[3.1.0]hexane,1-(4-methylphenyl)-, (?à)-; Bicifadine
Density: 1.091g/cm3
Boiling Point: 276.4°C at 760 mmHg
Flash Point: 125°C
PSA: 12.03000
LogP: 2.18470
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Chemistry

Molecular Structure of Bicifadine (CAS No.71195-57-8):
 
Molecular Formula: C12H15N
Molecular Weight: 173.25
CAS No: 71195-57-8
H bond acceptors: 1
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 3.24 Å2
Index of Refraction: 1.59
Molar Refractivity: 53.62 cm3
Molar Volume: 158.7 cm3
Surface Tension: 47.1 dyne/cm
Density: 1.091 g/cm3
Flash Point: 125 °C
Enthalpy of Vaporization: 51.49 kJ/mol
Boiling Point: 276.4 °C at 760 mmHg
Vapour Pressure: 0.0048 mmHg at 25°C
IUPAC Name: 5-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane
InChI: InChI=1S/C12H15N/c1-9-2-4-10(5-3-9)12-6-11(12)7-13-8-12/h2-5,11,13H,
6-8H2,1H3
InChIKey: OFYVIGTWSQPCLF-UHFFFAOYSA-N

Specification

   Bicifadine (CAS No.71195-57-8), it also can be called (-)-1-p-Tolyl-3-azabicyclo(3.1.0)hexane ; (±)-1-(4-methylphenyl)-3-azabicyclo[3.1.0]hexane ; (RS)-1-(4-Methylphenyl)-3-azabicyclo(3.1.0)hexan ; 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane ; 3-Azabicyclo[3.1.0]hexane, 1-(4-methylphenyl)- .