-
Name
Bicifadine
- EINECS
- CAS No. 71195-57-8
- Article Data1
- CAS DataBase
- Density 1.091g/cm3
- Solubility
- Melting Point
- Formula C12H15 N
- Boiling Point 276.4°C at 760 mmHg
- Molecular Weight 173.258
- Flash Point 125°C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 3-Azabicyclo[3.1.0]hexane,1-(4-methylphenyl)-, (?à)-; Bicifadine
- PSA 12.03000
- LogP 2.18470
Bicifadine Chemical Properties
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
Bicifadine 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)- .
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