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Home Carboxys 1-(2-Methylbenzoyl)piperidine-4-carboxylic acid

1-(2-Methylbenzoyl)piperidine-4-carboxylic acid

CAS No.:
401581-31-5
Catalog Number:
AG00751F
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$425
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00751F
Chemical Name:
1-(2-Methylbenzoyl)piperidine-4-carboxylic acid
CAS Number:
401581-31-5
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
MDL Number:
MFCD03015381
IUPAC Name:
1-(2-methylbenzoyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C14H17NO3/c1-10-4-2-3-5-12(10)13(16)15-8-6-11(7-9-15)14(17)18/h2-5,11H,6-9H2,1H3,(H,17,18)
InChI Key:
ZDLGPPDQCGOJTL-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)C(=O)c1ccccc1C
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.294g/mol
Monoisotopic Mass:
247.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
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