Home Carboxys ethyl 5-amino-1-(4-ethoxyphenyl)-1H-pyrazole-4-carboxylate

ethyl 5-amino-1-(4-ethoxyphenyl)-1H-pyrazole-4-carboxylate

CAS No.:
30829-69-7
Catalog Number:
AG01A0RC
Molecular Formula:
C14H17N3O3
Molecular Weight:
275.3031
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Product Description
Catalog Number:
AG01A0RC
Chemical Name:
ethyl 5-amino-1-(4-ethoxyphenyl)-1H-pyrazole-4-carboxylate
CAS Number:
30829-69-7
Molecular Formula:
C14H17N3O3
Molecular Weight:
275.3031
MDL Number:
MFCD07388501
IUPAC Name:
ethyl 5-amino-1-(4-ethoxyphenyl)pyrazole-4-carboxylate
InChI:
InChI=1S/C14H17N3O3/c1-3-19-11-7-5-10(6-8-11)17-13(15)12(9-16-17)14(18)20-4-2/h5-9H,3-4,15H2,1-2H3
InChI Key:
PEOYXLBODVTBTC-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)n1ncc(c1N)C(=O)OCC
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.127g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
275.308g/mol
Monoisotopic Mass:
275.127g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties