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88062-43-5 | 6H-1,3,4-Oxadiazin-6-one, 4,5-dihydro-4,5-diphenyl-
CAS No: 88062-43-5 Catalog No: AG004LBW MDL No:
Product Description
Catalog Number:
AG004LBW
Chemical Name:
6H-1,3,4-Oxadiazin-6-one, 4,5-dihydro-4,5-diphenyl-
CAS Number:
88062-43-5
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
IUPAC Name:
4,5-diphenyl-5H-1,3,4-oxadiazin-6-one
InChI:
InChI=1S/C15H12N2O2/c18-15-14(12-7-3-1-4-8-12)17(16-11-19-15)13-9-5-2-6-10-13/h1-11,14H
InChI Key:
MHNLNTIUDQWZKI-UHFFFAOYSA-N
SMILES:
O=C1OC=NN(C1c1ccccc1)c1ccccc1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.273g/mol
Monoisotopic Mass:
252.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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