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Home Other Building Blocks 2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetic acid

2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetic acid

CAS No.:
22091-43-6
Catalog Number:
AG01AI0F
Molecular Formula:
C11H8FNO3
Molecular Weight:
221.1845
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Product Description
Catalog Number:
AG01AI0F
Chemical Name:
2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetic acid
CAS Number:
22091-43-6
Molecular Formula:
C11H8FNO3
Molecular Weight:
221.1845
MDL Number:
MFCD11587873
IUPAC Name:
2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetic acid
InChI:
InChI=1S/C11H8FNO3/c12-8-3-1-7(2-4-8)11-13-9(6-16-11)5-10(14)15/h1-4,6H,5H2,(H,14,15)
InChI Key:
NSXNTASTGRAOHP-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1coc(n1)c1ccc(cc1)F
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.049g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.187g/mol
Monoisotopic Mass:
221.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Acetic acid aldose reductase inhibitors bearing a five-membered heterocyclic core with potent topical activity in a visual impairment rat model. Journal of medicinal chemistry 20080612
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties