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144189-88-8 | 1H-Benzimidazole, 1-[2-(1H-imidazol-1-yl)ethyl]-
CAS No: 144189-88-8 Catalog No: AG001J3O MDL No:
Product Description
Catalog Number:
AG001J3O
Chemical Name:
1H-Benzimidazole, 1-[2-(1H-imidazol-1-yl)ethyl]-
CAS Number:
144189-88-8
Molecular Formula:
C12H12N4
Molecular Weight:
212.2505
IUPAC Name:
1-(2-imidazol-1-ylethyl)benzimidazole
InChI:
InChI=1S/C12H12N4/c1-2-4-12-11(3-1)14-10-16(12)8-7-15-6-5-13-9-15/h1-6,9-10H,7-8H2
InChI Key:
SQHLVTLZGNYQEK-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)n(cn2)CCn1cncc1
NSC Number:
668469
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.256g/mol
Monoisotopic Mass:
212.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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