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828268-76-4 | 1H-Imidazole, 2-azido-, monoperchlorate
CAS No: 828268-76-4 Catalog No: AG0055TS MDL No:
Product Description
Catalog Number:
AG0055TS
Chemical Name:
1H-Imidazole, 2-azido-, monoperchlorate
CAS Number:
828268-76-4
Molecular Formula:
C3H4ClN5O4
Molecular Weight:
209.5480
IUPAC Name:
2-azido-1H-imidazole;perchloric acid
InChI:
InChI=1S/C3H3N5.ClHO4/c4-8-7-3-5-1-2-6-3;2-1(3,4)5/h1-2H,(H,5,6);(H,2,3,4,5)
InChI Key:
CJHNBYJTCYEXQW-UHFFFAOYSA-N
SMILES:
O[Cl](=O)(=O)=O.[N-]=[N+]=Nc1ncc[nH]1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.995g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.546g/mol
Monoisotopic Mass:
208.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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