Home Other Building Blocks 3-(6-fluoro-2-oxo-1,2,3,4-tetrahydroquinolin-1-yl)propanoic acid

3-(6-fluoro-2-oxo-1,2,3,4-tetrahydroquinolin-1-yl)propanoic acid

CAS No.:
1155516-10-1
Catalog Number:
AG01AKYB
Molecular Formula:
C12H12FNO3
Molecular Weight:
237.2270
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Product Description
Catalog Number:
AG01AKYB
Chemical Name:
3-(6-fluoro-2-oxo-1,2,3,4-tetrahydroquinolin-1-yl)propanoic acid
CAS Number:
1155516-10-1
Molecular Formula:
C12H12FNO3
Molecular Weight:
237.2270
MDL Number:
MFCD12413049
IUPAC Name:
3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)propanoic acid
InChI:
InChI=1S/C12H12FNO3/c13-9-2-3-10-8(7-9)1-4-11(15)14(10)6-5-12(16)17/h2-3,7H,1,4-6H2,(H,16,17)
InChI Key:
ZRLSHPXNIUZXJC-UHFFFAOYSA-N
SMILES:
OC(=O)CCN1C(=O)CCc2c1ccc(c2)F
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.23g/mol
Monoisotopic Mass:
237.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties