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Home Carboxys 1-(4-Fluorobenzoyl)piperidine-4-carboxylic acid

1-(4-Fluorobenzoyl)piperidine-4-carboxylic acid

CAS No.:
139679-45-1
Catalog Number:
AG001BHP
Molecular Formula:
C13H14FNO3
Molecular Weight:
251.2536
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG001BHP
Chemical Name:
1-(4-Fluorobenzoyl)piperidine-4-carboxylic acid
CAS Number:
139679-45-1
Molecular Formula:
C13H14FNO3
Molecular Weight:
251.2536
MDL Number:
MFCD02070181
IUPAC Name:
1-(4-fluorobenzoyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C13H14FNO3/c14-11-3-1-9(2-4-11)12(16)15-7-5-10(6-8-15)13(17)18/h1-4,10H,5-8H2,(H,17,18)
InChI Key:
NOBBVBPNOXXVPA-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)F)N1CCC(CC1)C(=O)O
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.257g/mol
Monoisotopic Mass:
251.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties