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947013-68-5 | 5-Chloro-1-methyl-1H-benzoimidazole-2-carboxylic acid
CAS No: 947013-68-5 Catalog No: AG01FODK MDL No:
Product Description
Catalog Number:
AG01FODK
Chemical Name:
5-Chloro-1-methyl-1H-benzoimidazole-2-carboxylic acid
CAS Number:
947013-68-5
IUPAC Name:
5-chloro-1-methylbenzimidazole-2-carboxylic acid
InChI:
InChI=1S/C9H7ClN2O2/c1-12-7-3-2-5(10)4-6(7)11-8(12)9(13)14/h2-4H,1H3,(H,13,14)
InChI Key:
GVLUKGCSZAAZJI-UHFFFAOYSA-N
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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