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Home Carboxys 1-Benzoylpiperidine-4-carboxylic acid

1-Benzoylpiperidine-4-carboxylic acid

CAS No.:
5274-99-7
Catalog Number:
AG00DDX7
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$63
- +
10g
98%
In Stock USA
United States
$113
- +
25g
98%
In Stock USA
United States
$238
- +
Product Description
Catalog Number:
AG00DDX7
Chemical Name:
1-Benzoylpiperidine-4-carboxylic acid
CAS Number:
5274-99-7
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD00040747
IUPAC Name:
1-benzoylpiperidine-4-carboxylic acid
InChI:
InChI=1S/C13H15NO3/c15-12(10-4-2-1-3-5-10)14-8-6-11(7-9-14)13(16)17/h1-5,11H,6-9H2,(H,16,17)
InChI Key:
ZTGMNCCDDKBPML-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)N1CCC(CC1)C(=O)O
EC Number:
226-099-2
NSC Number:
15149
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties