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Home > Imidazoles > 29914-81-6
29914-81-6 | 1,3-Bis(1H-benzo[d]imidazol-2-yl);benzene
CAS No: 29914-81-6 Catalog No: AG007K0Q MDL No:MFCD00623252
Product Description
Catalog Number:
AG007K0Q
Chemical Name:
1,3-Bis(1H-benzo[d]imidazol-2-yl);benzene
CAS Number:
29914-81-6
Molecular Formula:
C20H14N4
Molecular Weight:
310.3520
MDL Number:
MFCD00623252
IUPAC Name:
2-[3-(1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole
InChI:
InChI=1S/C20H14N4/c1-2-9-16-15(8-1)21-19(22-16)13-6-5-7-14(12-13)20-23-17-10-3-4-11-18(17)24-20/h1-12H,(H,21,22)(H,23,24)
InChI Key:
DNYDWFIQGPJANT-UHFFFAOYSA-N
SMILES:
c1cc(cc(c1)c1nc2c([nH]1)cccc2)c1nc2c([nH]1)cccc2
NSC Number:
133357
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.122g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
310.36g/mol
Monoisotopic Mass:
310.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Diacetatobis[1,3-bis-(benzimidazol-2-yl)benzene]zinc(II) dihydrate. | Acta crystallographica. Section E, Structure reports online 20080201 |
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