Home Halogens 2-(4-chlorophenyl)-5-ethyl-1H-imidazole-4-carboxylic acid

2-(4-chlorophenyl)-5-ethyl-1H-imidazole-4-carboxylic acid

CAS No.:
1156729-24-6
Catalog Number:
AG01BE9C
Molecular Formula:
C12H11ClN2O2
Molecular Weight:
250.6809
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Product Description
Catalog Number:
AG01BE9C
Chemical Name:
2-(4-chlorophenyl)-5-ethyl-1H-imidazole-4-carboxylic acid
CAS Number:
1156729-24-6
Molecular Formula:
C12H11ClN2O2
Molecular Weight:
250.6809
MDL Number:
MFCD12411561
IUPAC Name:
2-(4-chlorophenyl)-5-ethyl-1H-imidazole-4-carboxylic acid
InChI:
InChI=1S/C12H11ClN2O2/c1-2-9-10(12(16)17)15-11(14-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H,14,15)(H,16,17)
InChI Key:
KBNWQHBFWUPCTE-UHFFFAOYSA-N
SMILES:
CCc1[nH]c(nc1C(=O)O)c1ccc(cc1)Cl
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.051g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.682g/mol
Monoisotopic Mass:
250.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties