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

5-(3-fluorophenyl)-1,3-oxazole-4-carboxylic acid

CAS No.:
1083401-22-2
Catalog Number:
AG00HB62
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
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Product Description
Catalog Number:
AG00HB62
Chemical Name:
5-(3-fluorophenyl)-1,3-oxazole-4-carboxylic acid
CAS Number:
1083401-22-2
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
MDL Number:
MFCD07376193
IUPAC Name:
5-(3-fluorophenyl)-1,3-oxazole-4-carboxylic acid
InChI:
InChI=1S/C10H6FNO3/c11-7-3-1-2-6(4-7)9-8(10(13)14)12-5-15-9/h1-5H,(H,13,14)
InChI Key:
PLKBCEKRBXOTJA-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)c1ocnc1C(=O)O
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.033g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.16g/mol
Monoisotopic Mass:
207.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties