Bicyclo[2.2.1]hept-2-ene,5-phenyl-

Details:

1. Introduciton of Bicyclo[2.2.1]hept-2-ene,5-phenyl-

 

The Bicyclo[2.2.1]hept-2-ene,5-phenyl-, with its CAS NO 6143-30-2, is a kind of powder. It has synonyms of 2-Norbornene,5-phenyl- (6CI,7CI,8CI);5-Phenyl-2-norbornene and 5-Phenylbicyclo[2.2.1]hept-2-ene. Bicyclo[2.2.1]hept-2-ene,5-phenyl- should be stored in shady and cool warehouse.

 

2. Properties of Bicyclo[2.2.1]hept-2-ene,5-phenyl-

 

(1) ACD/LogP: 4.798   (2) ACD/LogD (pH 5.5): 4.80  (3) ACD/LogD (pH 7.4): 4.80
(4) ACD/BCF (pH 5.5): 2608.66   (5) ACD/BCF (pH 7.4): 2608.66
(6) ACD/KOC (pH 5.5): 9706.59   (7) ACD/KOC (pH 7.4): 9706.59
(8) #Freely Rotating Bonds: 1   (9) Index of Refraction: 1.583   (10) Molar Refractivity: 54.382 cm3
(11) Molar Volume: 162.69 cm3   (12) Polarizability: 21.559 10-24cm3
(13) Surface Tension: 41.8409996032715 dyne/cm   (14) Density: 1.046 g/cm3
(15) Flash Point: 98.975 °C   (16) Enthalpy of Vaporization: 46.609 kJ/mol
(17) Boiling Point: 248.548 °C at 760 mmHg   (18) Vapour Pressure: 0.0379999987781048 mmHg at 25°C
 

 

3. Structure descriptors of Bicyclo[2.2.1]hept-2-ene,5-phenyl-

 

IUPAC Name: 5-phenylbicyclo[2.2.1]hept-2-ene

InChI: InChI=1S/C13H14/c1-2-4-11(5-3-1)13-9-10-6-7-12(13)8-10/h1-7,10,12-13H,
8-9H2

InChIKey: PGNNHYNYFLXKDZ-UHFFFAOYSA-N

Canonical SMILES : C1C2CC(C1C=C2)C3=CC=CC=C3