Home Carboxys Ethyl 1-(4-fluorophenyl)-1h-pyrazole-4-carboxylate

Ethyl 1-(4-fluorophenyl)-1h-pyrazole-4-carboxylate

CAS No.:
138907-73-0
Catalog Number:
AG0019TF
Molecular Formula:
C12H11FN2O2
Molecular Weight:
234.2263
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Product Description
Catalog Number:
AG0019TF
Chemical Name:
Ethyl 1-(4-fluorophenyl)-1h-pyrazole-4-carboxylate
CAS Number:
138907-73-0
Molecular Formula:
C12H11FN2O2
Molecular Weight:
234.2263
MDL Number:
MFCD16036989
IUPAC Name:
ethyl 1-(4-fluorophenyl)pyrazole-4-carboxylate
InChI:
InChI=1S/C12H11FN2O2/c1-2-17-12(16)9-7-14-15(8-9)11-5-3-10(13)4-6-11/h3-8H,2H2,1H3
InChI Key:
MEUROLLIWZOVNK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn(c1)c1ccc(cc1)F
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.23g/mol
Monoisotopic Mass:
234.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties