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1516-73-0 | 1H-Benzimidazole, 2-azido-1-methyl-
CAS No: 1516-73-0 Catalog No: AG001NGM MDL No:
Product Description
Catalog Number:
AG001NGM
Chemical Name:
1H-Benzimidazole, 2-azido-1-methyl-
CAS Number:
1516-73-0
Molecular Formula:
C8H7N5
Molecular Weight:
173.1747
IUPAC Name:
2-azido-1-methylbenzimidazole
InChI:
InChI=1S/C8H7N5/c1-13-7-5-3-2-4-6(7)10-8(13)11-12-9/h2-5H,1H3
InChI Key:
UEBPHCPFYTWTGN-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1nc2c(n1C)cccc2
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.179g/mol
Monoisotopic Mass:
173.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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