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856-94-0 | 2H-Naphtho[1,2-b]pyran, 2,2-diphenyl-
CAS No: 856-94-0 Catalog No: AG004T4O MDL No:
Product Description
Catalog Number:
AG004T4O
Chemical Name:
2H-Naphtho[1,2-b]pyran, 2,2-diphenyl-
CAS Number:
856-94-0
Molecular Formula:
C25H18O
Molecular Weight:
334.4098
IUPAC Name:
2,2-diphenylbenzo[h]chromene
InChI:
InChI=1S/C25H18O/c1-3-10-21(11-4-1)25(22-12-5-2-6-13-22)18-17-20-16-15-19-9-7-8-14-23(19)24(20)26-25/h1-18H
InChI Key:
UWNYADTZRSHNGM-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1(C=Cc2c(O1)c1ccccc1cc2)c1ccccc1
Properties
Complexity:
478
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.136g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.418g/mol
Monoisotopic Mass:
334.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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