Home Carboxys 5-(2-hydroxyphenyl)-1H-pyrazole-3-carboxylic acid

5-(2-hydroxyphenyl)-1H-pyrazole-3-carboxylic acid

CAS No.:
46393-99-1
Catalog Number:
AG019UF1
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
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Product Description
Catalog Number:
AG019UF1
Chemical Name:
5-(2-hydroxyphenyl)-1H-pyrazole-3-carboxylic acid
CAS Number:
46393-99-1
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
MDL Number:
MFCD08282767
IUPAC Name:
3-(2-hydroxyphenyl)-1H-pyrazole-5-carboxylic acid
InChI:
InChI=1S/C10H8N2O3/c13-9-4-2-1-3-6(9)7-5-8(10(14)15)12-11-7/h1-5,13H,(H,11,12)(H,14,15)
InChI Key:
VTXQMHBETSEFDV-UHFFFAOYSA-N
SMILES:
Oc1ccccc1c1[nH]nc(c1)C(=O)O
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties