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1516-71-8 | 3H-Naphth[1,2-d]imidazole, 2-azido-3-methyl-
CAS No: 1516-71-8 Catalog No: AG001NGN MDL No:
Product Description
Catalog Number:
AG001NGN
Chemical Name:
3H-Naphth[1,2-d]imidazole, 2-azido-3-methyl-
CAS Number:
1516-71-8
Molecular Formula:
C12H9N5
Molecular Weight:
223.2334
IUPAC Name:
2-azido-3-methylbenzo[e]benzimidazole
InChI:
InChI=1S/C12H9N5/c1-17-10-7-6-8-4-2-3-5-9(8)11(10)14-12(17)15-16-13/h2-7H,1H3
InChI Key:
NXDIFTHOTABWBY-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1nc2c(n1C)ccc1c2cccc1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.086g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.239g/mol
Monoisotopic Mass:
223.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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