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28890-99-5 | 5H-Benzimidazo[1,2-a]benzimidazole
CAS No: 28890-99-5 Catalog No: AG002WZ5 MDL No:MFCD24551866
Product Description
Catalog Number:
AG002WZ5
Chemical Name:
5H-Benzimidazo[1,2-a]benzimidazole
CAS Number:
28890-99-5
Molecular Formula:
C13H9N3
Molecular Weight:
207.2307
MDL Number:
MFCD24551866
IUPAC Name:
6H-benzimidazolo[1,2-a]benzimidazole
InChI:
InChI=1S/C13H9N3/c1-3-7-11-9(5-1)14-13-15-10-6-2-4-8-12(10)16(11)13/h1-8H,(H,14,15)
InChI Key:
KLACMEYLRXQSMN-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nc1n2c2ccccc2[nH]1
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.236g/mol
Monoisotopic Mass:
207.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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