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15965-60-3 | 1H-Benzimidazole, 2-chloro-1,5-dimethyl-
CAS No: 15965-60-3 Catalog No: AG001RA4 MDL No:
Product Description
Catalog Number:
AG001RA4
Chemical Name:
1H-Benzimidazole, 2-chloro-1,5-dimethyl-
CAS Number:
15965-60-3
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
IUPAC Name:
2-chloro-1,5-dimethylbenzimidazole
InChI:
InChI=1S/C9H9ClN2/c1-6-3-4-8-7(5-6)11-9(10)12(8)2/h3-5H,1-2H3
InChI Key:
ZFNQWUCRBLFKDP-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc(n2C)Cl
Properties
Complexity:
174
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:
0
Isotope Atom Count:
0
Molecular Weight:
180.635g/mol
Monoisotopic Mass:
180.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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