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Home > Imidazoles > 79637-82-4
79637-82-4 | 1,4'-Bi-1H-imidazole(9CI)
CAS No: 79637-82-4 Catalog No: AG005IO3 MDL No:
Product Description
Catalog Number:
AG005IO3
Chemical Name:
1,4'-Bi-1H-imidazole(9CI)
CAS Number:
79637-82-4
Molecular Formula:
C6H6N4
Molecular Weight:
134.1386
IUPAC Name:
1-(1H-imidazol-5-yl)imidazole
InChI:
InChI=1S/C6H6N4/c1-2-10(5-7-1)6-3-8-4-9-6/h1-5H,(H,8,9)
InChI Key:
DIEJWUNVACYJEZ-UHFFFAOYSA-N
SMILES:
c1[nH]cc(n1)n1cncc1
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.142g/mol
Monoisotopic Mass:
134.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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