Home Carboxys 5-(2-fluoro-4-methoxyphenyl)-1,2-oxazole-3-carboxylic acid

5-(2-fluoro-4-methoxyphenyl)-1,2-oxazole-3-carboxylic acid

CAS No.:
953718-97-3
Catalog Number:
AG01A8BF
Molecular Formula:
C11H8FNO4
Molecular Weight:
237.1839
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Product Description
Catalog Number:
AG01A8BF
Chemical Name:
5-(2-fluoro-4-methoxyphenyl)-1,2-oxazole-3-carboxylic acid
CAS Number:
953718-97-3
Molecular Formula:
C11H8FNO4
Molecular Weight:
237.1839
MDL Number:
MFCD09729786
IUPAC Name:
5-(2-fluoro-4-methoxyphenyl)-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C11H8FNO4/c1-16-6-2-3-7(8(12)4-6)10-5-9(11(14)15)13-17-10/h2-5H,1H3,(H,14,15)
InChI Key:
JJOTVYNDKCWFOX-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)F)c1onc(c1)C(=O)O
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.044g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.186g/mol
Monoisotopic Mass:
237.044g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties