Home Carboxys 5-Oxo-pyrrolidine-2-carboxylic acid o-tolylamide

5-Oxo-pyrrolidine-2-carboxylic acid o-tolylamide

CAS No.:
4193-42-4
Catalog Number:
AG00I85N
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$244
- +
5g
98%
In Stock USA
United States
$975
- +
10g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00I85N
Chemical Name:
5-Oxo-pyrrolidine-2-carboxylic acid o-tolylamide
CAS Number:
4193-42-4
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
MDL Number:
MFCD00852350
IUPAC Name:
N-(2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
InChI:
InChI=1S/C12H14N2O2/c1-8-4-2-3-5-9(8)14-12(16)10-6-7-11(15)13-10/h2-5,10H,6-7H2,1H3,(H,13,15)(H,14,16)
InChI Key:
QDSSBKISDUDIEU-UHFFFAOYSA-N
SMILES:
O=C1CCC(N1)C(=O)Nc1ccccc1C
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
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