Home Other Building Blocks 3-(6-fluoro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)propanoic acid

3-(6-fluoro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)propanoic acid

CAS No.:
1016767-95-5
Catalog Number:
AG01A7NV
Molecular Formula:
C11H8FNO4
Molecular Weight:
237.1839
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Product Description
Catalog Number:
AG01A7NV
Chemical Name:
3-(6-fluoro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)propanoic acid
CAS Number:
1016767-95-5
Molecular Formula:
C11H8FNO4
Molecular Weight:
237.1839
MDL Number:
MFCD09808686
IUPAC Name:
3-(6-fluoro-2,3-dioxoindol-1-yl)propanoic acid
InChI:
InChI=1S/C11H8FNO4/c12-6-1-2-7-8(5-6)13(4-3-9(14)15)11(17)10(7)16/h1-2,5H,3-4H2,(H,14,15)
InChI Key:
NDBRGBUSAXNPBY-UHFFFAOYSA-N
SMILES:
OC(=O)CCN1C(=O)C(=O)c2c1cc(F)cc2
Properties
Complexity:
371  
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:
5  
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:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties