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Home > Imidazoles > 86790-59-2
86790-59-2 | 2(5H)-Furanimine, 4-(1H-imidazol-1-yl)-5,5-dimethyl-
CAS No: 86790-59-2 Catalog No: AG004JHP MDL No:
Product Description
Catalog Number:
AG004JHP
Chemical Name:
2(5H)-Furanimine, 4-(1H-imidazol-1-yl)-5,5-dimethyl-
CAS Number:
86790-59-2
Molecular Formula:
C9H11N3O
Molecular Weight:
177.2031
IUPAC Name:
4-imidazol-1-yl-5,5-dimethylfuran-2-imine
InChI:
InChI=1S/C9H11N3O/c1-9(2)7(5-8(10)13-9)12-4-3-11-6-12/h3-6,10H,1-2H3
InChI Key:
SLYULNXYUCHOIJ-UHFFFAOYSA-N
SMILES:
N=C1C=C(C(O1)(C)C)n1cncc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.09g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.207g/mol
Monoisotopic Mass:
177.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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