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Home > Other Heterocycles > 89398-55-0
89398-55-0 | Bicyclo[6.2.1]undec-8-ene, 1-phenyl-
CAS No: 89398-55-0 Catalog No: AG003WAR MDL No:
Product Description
Catalog Number:
AG003WAR
Chemical Name:
Bicyclo[6.2.1]undec-8-ene, 1-phenyl-
CAS Number:
89398-55-0
Molecular Formula:
C17H22
Molecular Weight:
226.3566
IUPAC Name:
8-phenylbicyclo[6.2.1]undec-1(10)-ene
InChI:
InChI=1S/C17H22/c1-2-7-12-17(16-9-5-3-6-10-16)13-11-15(14-17)8-4-1/h3,5-6,9-11H,1-2,4,7-8,12-14H2
InChI Key:
IWMNKZWJUQGZHE-UHFFFAOYSA-N
SMILES:
C1CCCC2(CC(=CC2)CC1)c1ccccc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.172g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.363g/mol
Monoisotopic Mass:
226.172g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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