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Home > Imidazoles > 108035-44-5
108035-44-5 | Benzoic acid, 4-(2-Methyl-1H-iMidazol-1-yl)-, ethyl ester
CAS No: 108035-44-5 Catalog No: AG0096V8 MDL No:
Product Description
Catalog Number:
AG0096V8
Chemical Name:
Benzoic acid, 4-(2-Methyl-1H-iMidazol-1-yl)-, ethyl ester
CAS Number:
108035-44-5
IUPAC Name:
ethyl 4-(2-methylimidazol-1-yl)benzoate
InChI:
InChI=1S/C13H14N2O2/c1-3-17-13(16)11-4-6-12(7-5-11)15-9-8-14-10(15)2/h4-9H,3H2,1-2H3
InChI Key:
DGYUNNISKYKIDM-UHFFFAOYSA-N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.267g/mol
Monoisotopic Mass:
230.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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