1H-Benzimidazole-5-carboxylic acid, 7-methyl-2-propyl-, methyl ester


Chemical Name: 1H-Benzimidazole-5-carboxylic acid, 7-methyl-2-propyl-, methyl ester
CAS Number: 152628-00-7
Product Number: AG007YKH(AGN-PC-0O4CK0)
Synonyms:
MDL No:
Molecular Formula: C13H16N2O2
Molecular Weight: 232.2783

Identification/Properties


Computed Properties
Molecular Weight:
232.283g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
232.121g/mol
Monoisotopic Mass:
232.121g/mol
Topological Polar Surface Area:
55A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
283
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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