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88100-23-6 | 1H-Imidazole-5-carboxamide, 1-ethyl-4-methoxy-
CAS No: 88100-23-6 Catalog No: AG008CLK MDL No:MFCD20714423
Product Description
Catalog Number:
AG008CLK
Chemical Name:
1H-Imidazole-5-carboxamide, 1-ethyl-4-methoxy-
CAS Number:
88100-23-6
Molecular Formula:
C7H11N3O2
Molecular Weight:
169.1811
MDL Number:
MFCD20714423
IUPAC Name:
3-ethyl-5-methoxyimidazole-4-carboxamide
InChI:
InChI=1S/C7H11N3O2/c1-3-10-4-9-7(12-2)5(10)6(8)11/h4H,3H2,1-2H3,(H2,8,11)
InChI Key:
MYVOCWFKTLTHOH-UHFFFAOYSA-N
SMILES:
COc1ncn(c1C(=O)N)CC
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.085g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.184g/mol
Monoisotopic Mass:
169.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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