Home Halogens 1H-Benzimidazole,2-chloro-5-methyl-(9CI)

1H-Benzimidazole,2-chloro-5-methyl-(9CI)

CAS No.:
4887-94-9
Catalog Number:
AG00DJBZ
Molecular Formula:
C8H7ClN2
Molecular Weight:
166.6076
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Product Description
Catalog Number:
AG00DJBZ
Chemical Name:
1H-Benzimidazole,2-chloro-5-methyl-(9CI)
CAS Number:
4887-94-9
Molecular Formula:
C8H7ClN2
Molecular Weight:
166.6076
MDL Number:
MFCD11046672
IUPAC Name:
2-chloro-6-methyl-1H-benzimidazole
InChI:
InChI=1S/C8H7ClN2/c1-5-2-3-6-7(4-5)11-8(9)10-6/h2-4H,1H3,(H,10,11)
InChI Key:
KBSHNSLMNALPCU-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc([nH]2)Cl
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.608g/mol
Monoisotopic Mass:
166.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties