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26479-00-5 | 2H-Pyran-2-thione, 4,6-diphenyl-
CAS No: 26479-00-5 Catalog No: AG002TDE MDL No:
Product Description
Catalog Number:
AG002TDE
Chemical Name:
2H-Pyran-2-thione, 4,6-diphenyl-
CAS Number:
26479-00-5
Molecular Formula:
C17H12OS
Molecular Weight:
264.3416
IUPAC Name:
4,6-diphenylpyran-2-thione
InChI:
InChI=1S/C17H12OS/c19-17-12-15(13-7-3-1-4-8-13)11-16(18-17)14-9-5-2-6-10-14/h1-12H
InChI Key:
YBLGRWHNMKFMAS-UHFFFAOYSA-N
SMILES:
S=c1cc(cc(o1)c1ccccc1)c1ccccc1
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.342g/mol
Monoisotopic Mass:
264.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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