Home Carboxys 1-[(6-Oxo-1,6-dihydropyridin-3-yl)carbonyl]piperidine-4-carboxylic acid

1-[(6-Oxo-1,6-dihydropyridin-3-yl)carbonyl]piperidine-4-carboxylic acid

CAS No.:
697257-26-4
Catalog Number:
AG00FD7C
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG00FD7C
Chemical Name:
1-[(6-Oxo-1,6-dihydropyridin-3-yl)carbonyl]piperidine-4-carboxylic acid
CAS Number:
697257-26-4
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
MDL Number:
MFCD09942648
IUPAC Name:
1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C12H14N2O4/c15-10-2-1-9(7-13-10)11(16)14-5-3-8(4-6-14)12(17)18/h1-2,7-8H,3-6H2,(H,13,15)(H,17,18)
InChI Key:
IXNULTKZCDKNME-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)C(=O)c1ccc(=O)[nH]c1
Properties
Complexity:
445  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.254g/mol
Monoisotopic Mass:
250.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties