Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl- CAS NO.6056-35-5

1. Introduction ofMethanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-

Methanone,bicyclo[2.2.1]hept-5-en…

1. Introduction of Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-

 

Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-, with its CAS NO 6056-35-5, is a kind of liquid. It has synonyms of Ketone,5-norbornen-2-yl phenyl (6CI,7CI,8CI). Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl- should be stored in shady and cool warehouse.

 

2. Properties of Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-

 

(1) XLogP3-AA 3  (2) H-Bond Acceptor 1  (3) Rotatable Bond Count 2
(4) Tautomer Count 2  (5) Exact Mass 198.104465  (6) MonoIsotopic Mass 198.104465
(7) Topological Polar Surface Area 17.1 (8) Heavy Atom Count 15  (9) Complexity 286 
(10) Undefined Atom Stereocenter Count 3 (11) Covalently-Bonded Unit Count 1
(12) Feature 3D Acceptor Count 1 (13) Feature 3D Ring Count 2 (14) Effective Rotor Count 2.6
(15) Conformer Sampling RMSD 0.6 (16) CID Conformer Count 24
 

3. Structure descriptors of Methanone,bicyclo[2.2.1]hept-5-en-2-ylphenyl-

 

IUPAC Name: 5-bicyclo[2.2.1]hept-2-enyl(phenyl)methanone

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

InChIKey: RMHYEJKELLBHSV-UHFFFAOYSA-N

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