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Home > Other Heterocycles > 88649-18-7
88649-18-7 | Bicyclo[2.2.1]heptane, 2-(1,2-diphenylethenyl)-
CAS No: 88649-18-7 Catalog No: AG00497F MDL No:
Product Description
Catalog Number:
AG00497F
Chemical Name:
Bicyclo[2.2.1]heptane, 2-(1,2-diphenylethenyl)-
CAS Number:
88649-18-7
Molecular Formula:
C21H22
Molecular Weight:
274.3994
IUPAC Name:
2-(1,2-diphenylethenyl)bicyclo[2.2.1]heptane
InChI:
InChI=1S/C21H22/c1-3-7-16(8-4-1)14-20(18-9-5-2-6-10-18)21-15-17-11-12-19(21)13-17/h1-10,14,17,19,21H,11-13,15H2
InChI Key:
VNGYXNNVQMIJHD-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C=C(C1CC2CC1CC2)c1ccccc1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.172g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.407g/mol
Monoisotopic Mass:
274.172g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
1
XLogP3:
6.7
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