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89196-87-2 | Oxaziridinium, 2-oxo-3,3-diphenyl-
CAS No: 89196-87-2 Catalog No: AG004NEG MDL No:
Product Description
Catalog Number:
AG004NEG
Chemical Name:
Oxaziridinium, 2-oxo-3,3-diphenyl-
CAS Number:
89196-87-2
Molecular Formula:
C13H10NO2+
Molecular Weight:
212.2240
IUPAC Name:
3,3-diphenyloxaziridin-2-ium 2-oxide
InChI:
InChI=1S/C13H10NO2/c15-14-13(16-14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H/q+1
InChI Key:
IMHXQYIPAUILKS-UHFFFAOYSA-N
SMILES:
O=[N+]1OC1(c1ccccc1)c1ccccc1
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.071g/mol
Formal Charge:
1
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.228g/mol
Monoisotopic Mass:
212.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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