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

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

CAS No.:
1017513-51-7
Catalog Number:
AG00JW3Y
Molecular Formula:
C10H5F2NO3
Molecular Weight:
225.1484
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Product Description
Catalog Number:
AG00JW3Y
Chemical Name:
5-(3,4-difluorophenyl)-1,2-oxazole-3-carboxylic acid
CAS Number:
1017513-51-7
Molecular Formula:
C10H5F2NO3
Molecular Weight:
225.1484
MDL Number:
MFCD07377121
IUPAC Name:
5-(3,4-difluorophenyl)-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C10H5F2NO3/c11-6-2-1-5(3-7(6)12)9-4-8(10(14)15)13-16-9/h1-4H,(H,14,15)
InChI Key:
GUQAHOANQYNQHL-UHFFFAOYSA-N
SMILES:
OC(=O)c1noc(c1)c1ccc(c(c1)F)F
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.024g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.151g/mol
Monoisotopic Mass:
225.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties