Home Carboxys 4-hydroxy-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid

4-hydroxy-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid

CAS No.:
1152601-80-3
Catalog Number:
AG019X9W
Molecular Formula:
C11H10N2O4
Molecular Weight:
234.2081
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Product Description
Catalog Number:
AG019X9W
Chemical Name:
4-hydroxy-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid
CAS Number:
1152601-80-3
Molecular Formula:
C11H10N2O4
Molecular Weight:
234.2081
MDL Number:
MFCD11133582
IUPAC Name:
4-hydroxy-1-(4-methoxyphenyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C11H10N2O4/c1-17-8-4-2-7(3-5-8)13-6-9(14)10(12-13)11(15)16/h2-6,14H,1H3,(H,15,16)
InChI Key:
FPAAXOFYZPRRCS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1cc(c(n1)C(=O)O)O
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.064g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.211g/mol
Monoisotopic Mass:
234.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties