sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 1-(4-Chlorobenzoyl)-4-piperidinecarboxylic acid

1-(4-Chlorobenzoyl)-4-piperidinecarboxylic acid

CAS No.:
379724-54-6
Catalog Number:
AG00C8H0
Molecular Formula:
C13H14ClNO3
Molecular Weight:
267.7082
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
Product Description
Catalog Number:
AG00C8H0
Chemical Name:
1-(4-Chlorobenzoyl)-4-piperidinecarboxylic acid
CAS Number:
379724-54-6
Molecular Formula:
C13H14ClNO3
Molecular Weight:
267.7082
MDL Number:
MFCD03014156
IUPAC Name:
1-(4-chlorobenzoyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C13H14ClNO3/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:
FGLQAKJRFPNIJT-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)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:
267.066g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.709g/mol
Monoisotopic Mass:
267.066g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties