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1,1'-Diethyl-1H,1'H-[2,2']Biimidazolyl

Catalog Number
ACM37572502
CAS Number
37572-50-2
Product Name
1,1'-Diethyl-1H,1'H-[2,2']Biimidazolyl
Structure
Category
Nitrogen-containing MOF ligand-binary nitrogen-containing MOF ligand
Synonyms
1,1'-DIETHYL-1H,1'H-[2,2']BIIMIDAZOLYL
IUPAC Name
1-ethyl-2-(1-ethylimidazol-2-yl)imidazole
Molecular Weight
190.24496
Molecular Formula
C10H14N4
Canonical SMILES
CCN1C=CN=C1C2=NC=CN2CC
InChI
InChI=1S/C10H14N4/c1-3-13-7-5-11-9(13)10-12-6-8-14(10)4-2/h5-8H,3-4H2,1-2H3
InChI Key
PRTVHGIPJBZJKX-UHFFFAOYSA-N
Purity
96%
Complexity
165
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
190.121846464g/mol
Formal Charge
0
Heavy Atom Count
14
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
190.121846464g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
35.6Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
0.4
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