Home Other Building Blocks ethyl 2-(1-ethyl-1H-pyrazol-4-yl)-2-oxoacetate

ethyl 2-(1-ethyl-1H-pyrazol-4-yl)-2-oxoacetate

CAS No.:
1235995-82-0
Catalog Number:
AG01A31W
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
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Product Description
Catalog Number:
AG01A31W
Chemical Name:
ethyl 2-(1-ethyl-1H-pyrazol-4-yl)-2-oxoacetate
CAS Number:
1235995-82-0
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
MDL Number:
MFCD18889909
IUPAC Name:
ethyl 2-(1-ethylpyrazol-4-yl)-2-oxoacetate
InChI:
InChI=1S/C9H12N2O3/c1-3-11-6-7(5-10-11)8(12)9(13)14-4-2/h5-6H,3-4H2,1-2H3
InChI Key:
QVLCZGUYRLBNIG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)c1cnn(c1)CC
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties