Home Carboxys 1-(3-fluorophenyl)-6-oxopiperidine-3-carboxylic acid

1-(3-fluorophenyl)-6-oxopiperidine-3-carboxylic acid

CAS No.:
1285045-55-7
Catalog Number:
AG01B52X
Molecular Formula:
C12H12FNO3
Molecular Weight:
237.2270
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Product Description
Catalog Number:
AG01B52X
Chemical Name:
1-(3-fluorophenyl)-6-oxopiperidine-3-carboxylic acid
CAS Number:
1285045-55-7
Molecular Formula:
C12H12FNO3
Molecular Weight:
237.2270
MDL Number:
MFCD17958536
IUPAC Name:
1-(3-fluorophenyl)-6-oxopiperidine-3-carboxylic acid
InChI:
InChI=1S/C12H12FNO3/c13-9-2-1-3-10(6-9)14-7-8(12(16)17)4-5-11(14)15/h1-3,6,8H,4-5,7H2,(H,16,17)
InChI Key:
QTEXNGJSKPHGAF-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(=O)N(C1)c1cccc(c1)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:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties