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Home Halogens N-Cyclopentyl 3-bromo-5-nitrobenzamide

N-Cyclopentyl 3-bromo-5-nitrobenzamide

CAS No.:
941294-18-4
Catalog Number:
AG003SXD
Molecular Formula:
C12H13BrN2O3
Molecular Weight:
313.1472
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG003SXD
Chemical Name:
N-Cyclopentyl 3-bromo-5-nitrobenzamide
CAS Number:
941294-18-4
Molecular Formula:
C12H13BrN2O3
Molecular Weight:
313.1472
MDL Number:
MFCD09475860
IUPAC Name:
3-bromo-N-cyclopentyl-5-nitrobenzamide
InChI:
InChI=1S/C12H13BrN2O3/c13-9-5-8(6-11(7-9)15(17)18)12(16)14-10-3-1-2-4-10/h5-7,10H,1-4H2,(H,14,16)
InChI Key:
LBQLJGUFWGRRPS-UHFFFAOYSA-N
SMILES:
Brc1cc(cc(c1)[N+](=O)[O-])C(=O)NC1CCCC1
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.011g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
313.151g/mol
Monoisotopic Mass:
312.011g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties