Home Carbonyls 4-Nitro-1-(pyrrolidinocarbonyl)benzene

4-Nitro-1-(pyrrolidinocarbonyl)benzene

CAS No.:
53578-11-3
Catalog Number:
AG00DKG7
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
10g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG00DKG7
Chemical Name:
4-Nitro-1-(pyrrolidinocarbonyl)benzene
CAS Number:
53578-11-3
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD00578423
IUPAC Name:
(4-nitrophenyl)-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C11H12N2O3/c14-11(12-7-1-2-8-12)9-3-5-10(6-4-9)13(15)16/h3-6H,1-2,7-8H2
InChI Key:
VIPIQYQJPCFIER-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])N1CCCC1
NSC Number:
677744
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
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