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98199-08-7 | 2H-Oxireno[f]benzimidazole(9CI)
CAS No: 98199-08-7 Catalog No: AG006923 MDL No:
Product Description
Catalog Number:
AG006923
Chemical Name:
2H-Oxireno[f]benzimidazole(9CI)
CAS Number:
98199-08-7
Molecular Formula:
C7H4N2O
Molecular Weight:
132.1195
IUPAC Name:
2H-oxireno[2,3-f]benzimidazole
InChI:
InChI=1S/C7H4N2O/c1-4-5(9-3-8-4)2-7-6(1)10-7/h1,3H,2H2
InChI Key:
PDHKSUALRYZFMJ-UHFFFAOYSA-N
SMILES:
C1=NC2=CC3=C(CC2=N1)O3
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.032g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.122g/mol
Monoisotopic Mass:
132.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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