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Home > Imidazoles > 114833-94-2
114833-94-2 | Pyrimidine, 2,4-di-1H-imidazol-1-yl-
CAS No: 114833-94-2 Catalog No: AG000FBQ MDL No:
Product Description
Catalog Number:
AG000FBQ
Chemical Name:
Pyrimidine, 2,4-di-1H-imidazol-1-yl-
CAS Number:
114833-94-2
Molecular Formula:
C10H8N6
Molecular Weight:
212.2107
IUPAC Name:
2,4-di(imidazol-1-yl)pyrimidine
InChI:
InChI=1S/C10H8N6/c1-2-13-10(16-6-4-12-8-16)14-9(1)15-5-3-11-7-15/h1-8H
InChI Key:
DWNKNOSIDWJEBZ-UHFFFAOYSA-N
SMILES:
n1ccn(c1)c1ccnc(n1)n1ccnc1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.081g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.216g/mol
Monoisotopic Mass:
212.081g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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