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110534-15-1 | Benzimidazole, 5(or 6)-tert-butyl- (6CI)
CAS No: 110534-15-1 Catalog No: AG008YOC MDL No:
Product Description
Catalog Number:
AG008YOC
Chemical Name:
Benzimidazole, 5(or 6)-tert-butyl- (6CI)
CAS Number:
110534-15-1
IUPAC Name:
6-tert-butyl-1H-benzimidazole
InChI:
InChI=1S/C11H14N2/c1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-7H,1-3H3,(H,12,13)
InChI Key:
DWAWUJTUMDEWBR-UHFFFAOYSA-N
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.247g/mol
Monoisotopic Mass:
174.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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