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6056-35-5

Basic Information
CAS No.: 6056-35-5
Name: 2-BENZOYL-5-NORBORNENE
Article Data: 12
Molecular Structure:
Molecular Structure of 6056-35-5 (2-BENZOYL-5-NORBORNENE)
Formula: C14H14O
Molecular Weight: 198.265
Synonyms: Ketone,5-norbornen-2-yl phenyl (6CI,7CI,8CI);
EINECS: 227-983-0
Density: 1.13 g/cm3
Boiling Point: 296.881 °C at 760 mmHg
Flash Point: 132.069 °C
Appearance: clear yellow-orange to brown liquid
Safety: 24/25
PSA: 17.07000
LogP: 3.08150
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Specification

The Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-, with CAS registry number 6056-35-5, belongs to the following product category: Norbornene Derivatives. It has the systematic name of (1R,2S,4R)-bicyclo[2.2.1]hept-5-en-2-yl(phenyl)methanone. This chemical is a kind of clear yellow-orange to brown liquid. When use this chemical, avoid contact with skin and eyes.

Physical properties of Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-: (1)ACD/LogP: 3.46; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 17.07 Å2; (7)Index of Refraction: 1.594; (8)Molar Refractivity: 59.583 cm3; (9)Molar Volume: 175.52 cm3; (10)Polarizability: 23.621×10-24cm3; (11)Surface Tension: 47.197 dyne/cm; (12)Density: 1.13 g/cm3; (13)Flash Point: 132.069 °C; (14)Enthalpy of Vaporization: 53.669 kJ/mol; (15)Boiling Point: 296.881 °C at 760 mmHg; (16)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)[C@H]2C[C@@H]3/C=C\[C@H]2C3
(2)InChI: InChI=1/C14H14O/c15-14(11-4-2-1-3-5-11)13-9-10-6-7-12(13)8-10/h1-7,10,12-13H,8-9H2/t10-,12+,13+/m1/s1
(3)InChIKey: RMHYEJKELLBHSV-WXHSDQCUBT
(4)Std. InChI: InChI=1S/C14H14O/c15-14(11-4-2-1-3-5-11)13-9-10-6-7-12(13)8-10/h1-7,10,12-13H,8-9H2/t10-,12+,13+/m1/s1
(5)Std. InChIKey: RMHYEJKELLBHSV-WXHSDQCUSA-N