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1010-92-0 | 2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetamide
CAS No: 1010-92-0 Catalog No: AG01DT38 MDL No:
Product Description
Catalog Number:
AG01DT38
Chemical Name:
2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetamide
CAS Number:
1010-92-0
Molecular Formula:
C6H8N4O3
Molecular Weight:
184.1527
IUPAC Name:
2-(2-methyl-5-nitroimidazol-1-yl)acetamide
InChI:
InChI=1S/C6H8N4O3/c1-4-8-2-6(10(12)13)9(4)3-5(7)11/h2H,3H2,1H3,(H2,7,11)
InChI Key:
AQHNMNBJODZNFK-UHFFFAOYSA-N
SMILES:
NC(=O)Cn1c(C)ncc1[N+](=O)[O-]
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.06g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.155g/mol
Monoisotopic Mass:
184.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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