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Home > Imidazoles > 880495-49-8
880495-49-8 | 1H-Imidazole, 1-[(3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]-
CAS No: 880495-49-8 Catalog No: AG008DB0 MDL No:
Product Description
Catalog Number:
AG008DB0
Chemical Name:
1H-Imidazole, 1-[(3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]-
CAS Number:
880495-49-8
Molecular Formula:
C10H12N4O
Molecular Weight:
204.2285
IUPAC Name:
(5-ethyl-2-methylpyrazol-3-yl)-imidazol-1-ylmethanone
InChI:
InChI=1S/C10H12N4O/c1-3-8-6-9(13(2)12-8)10(15)14-5-4-11-7-14/h4-7H,3H2,1-2H3
InChI Key:
IDQNAMAUHRQWSC-UHFFFAOYSA-N
SMILES:
CCc1nn(c(c1)C(=O)n1cncc1)C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.233g/mol
Monoisotopic Mass:
204.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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