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5-[4-(1-Imidazolyl)phenyl]-2H-tetrazole

Catalog Number
ACM188890724-2
CAS Number
188890-72-4
Product Name
5-[4-(1-Imidazolyl)phenyl]-2H-tetrazole
Structure
Category
Nitrogen-containing MOF ligand-binary nitrogen-containing MOF ligand
Synonyms
5-[4-(1H-Imidazol-1-Yl)phenyl]-2H-1,2,3,4-tetraazole
IUPAC Name
5-(4-imidazol-1-ylphenyl)-2H-tetrazole
Molecular Weight
212.21
Molecular Formula
C10H8N6
InChI
InChI=1S/C10H8N6/c1-3-9(16-6-5-11-7-16)4-2-8(1)10-12-14-15-13-10/h1-7H,(H,12,13,14,15)
InChI Key
WHAKQPDVCLWKOT-UHFFFAOYSA-N
Purity
97%
Appearance
Dark yellow solid
Complexity
227
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
212.08104428g/mol
Formal Charge
0
Heavy Atom Count
16
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
212.08104428g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
72.3Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
0.9
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