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Home > Other Heterocycles > 656260-00-3
656260-00-3 | Bicyclo[2.2.1]heptane, 7,7-bis(2-methoxyphenyl)-1-phenyl-
CAS No: 656260-00-3 Catalog No: AG006Q8I MDL No:
Product Description
Catalog Number:
AG006Q8I
Chemical Name:
Bicyclo[2.2.1]heptane, 7,7-bis(2-methoxyphenyl)-1-phenyl-
CAS Number:
656260-00-3
Molecular Formula:
C27H28O2
Molecular Weight:
384.5100
IUPAC Name:
7,7-bis(2-methoxyphenyl)-1-phenylbicyclo[2.2.1]heptane
InChI:
InChI=1S/C27H28O2/c1-28-24-14-8-6-12-22(24)27(23-13-7-9-15-25(23)29-2)21-16-18-26(27,19-17-21)20-10-4-3-5-11-20/h3-15,21H,16-19H2,1-2H3
InChI Key:
QVDAOAGGGJUWKG-UHFFFAOYSA-N
SMILES:
COc1ccccc1C1(C2CCC1(CC2)c1ccccc1)c1ccccc1OC
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.209g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.519g/mol
Monoisotopic Mass:
384.209g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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