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Home Carbonyls 2-(Piperidin-1-ylcarbonyl)benzoic acid

2-(Piperidin-1-ylcarbonyl)benzoic acid

CAS No.:
20320-44-9
Catalog Number:
AG0028QN
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$125
- +
1g
95%
In Stock USA
United States
$350
- +
5g
95%
In Stock USA
United States
$1025
- +
10g
95%
In Stock USA
United States
$1525
- +
Product Description
Catalog Number:
AG0028QN
Chemical Name:
2-(Piperidin-1-ylcarbonyl)benzoic acid
CAS Number:
20320-44-9
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD00443957
IUPAC Name:
2-(piperidine-1-carbonyl)benzoic acid
InChI:
InChI=1S/C13H15NO3/c15-12(14-8-4-1-5-9-14)10-6-2-3-7-11(10)13(16)17/h2-3,6-7H,1,4-5,8-9H2,(H,16,17)
InChI Key:
BIUIFJPSZVWHIX-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1C(=O)O)N1CCCCC1
UNII:
3M0TMG2SGU
NSC Number:
175179
Properties
Complexity:
297  
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:
1.5  
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