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

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

CAS No.:
34569-15-8
Catalog Number:
AG00C6XD
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
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Product Description
Catalog Number:
AG00C6XD
Chemical Name:
1H-Benzimidazole,5-chloro-2-ethyl-(9CI)
CAS Number:
34569-15-8
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
MDL Number:
MFCD18800923
IUPAC Name:
6-chloro-2-ethyl-1H-benzimidazole
InChI:
InChI=1S/C9H9ClN2/c1-2-9-11-7-4-3-6(10)5-8(7)12-9/h3-5H,2H2,1H3,(H,11,12)
InChI Key:
AIXMQUWDZVRMJJ-UHFFFAOYSA-N
SMILES:
CCc1nc2c([nH]1)cc(cc2)Cl
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.045g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.635g/mol
Monoisotopic Mass:
180.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties