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Home > Imidazoles > 1306607-10-2
1306607-10-2 | 5-acetyl-2-methyl-1H-imidazole-4-carboxamide
CAS No: 1306607-10-2 Catalog No: AG01AIEF MDL No:MFCD18839030
Product Description
Catalog Number:
AG01AIEF
Chemical Name:
5-acetyl-2-methyl-1H-imidazole-4-carboxamide
CAS Number:
1306607-10-2
Molecular Formula:
C7H9N3O2
Molecular Weight:
167.1653
MDL Number:
MFCD18839030
IUPAC Name:
4-acetyl-2-methyl-1H-imidazole-5-carboxamide
InChI:
InChI=1S/C7H9N3O2/c1-3(11)5-6(7(8)12)10-4(2)9-5/h1-2H3,(H2,8,12)(H,9,10)
InChI Key:
LLRRIULRWVSUBE-UHFFFAOYSA-N
SMILES:
Cc1[nH]c(c(n1)C(=O)N)C(=O)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.069g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.168g/mol
Monoisotopic Mass:
167.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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