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78196-70-0 | 2,2'-Bi-1H-benzimidazole,6,6'-dimethyl-
CAS No: 78196-70-0 Catalog No: AG005D23 MDL No:
Product Description
Catalog Number:
AG005D23
Chemical Name:
2,2'-Bi-1H-benzimidazole,6,6'-dimethyl-
CAS Number:
78196-70-0
Molecular Formula:
C16H14N4
Molecular Weight:
262.3092
IUPAC Name:
6-methyl-2-(6-methyl-1H-benzimidazol-2-yl)-1H-benzimidazole
InChI:
InChI=1S/C16H14N4/c1-9-3-5-11-13(7-9)19-15(17-11)16-18-12-6-4-10(2)8-14(12)20-16/h3-8H,1-2H3,(H,17,19)(H,18,20)
InChI Key:
LTRADJKPFBPZJG-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)[nH]c(n2)c1nc2c([nH]1)cc(cc2)C
NSC Number:
54093
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.122g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
262.316g/mol
Monoisotopic Mass:
262.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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