Home Nitros 2H-1-Benzopyran-2-one, 3-nitro-

2H-1-Benzopyran-2-one, 3-nitro-

CAS No.:
28448-04-6
Catalog Number:
AG007KLC
Molecular Formula:
C9H5NO4
Molecular Weight:
191.1403
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG007KLC
Chemical Name:
2H-1-Benzopyran-2-one, 3-nitro-
CAS Number:
28448-04-6
Molecular Formula:
C9H5NO4
Molecular Weight:
191.1403
MDL Number:
MFCD00233577
IUPAC Name:
3-nitrochromen-2-one
InChI:
InChI=1S/C9H5NO4/c11-9-7(10(12)13)5-6-3-1-2-4-8(6)14-9/h1-5H
InChI Key:
YTCVPEZECJYZRK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2ccccc2oc1=O
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.022g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.142g/mol
Monoisotopic Mass:
191.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Complete assignment of the 1H and 13C NMR spectra of antimicrobial 4-arylamino- 3-nitrocoumarin derivatives. Magnetic resonance in chemistry : MRC 20101101
Biorelevant refinement of the Caco-2 cell culture model to assess efficacy of paracellular permeability enhancers. Journal of pharmaceutical sciences 20080501
QSAR study of antimicrobial activity of some 3-nitrocoumarins and related compounds. Journal of chemical information and modeling 20070101
Diacylglycerol and its formation by phospholipase C regulate Rab- and SNARE-dependent yeast vacuole fusion. The Journal of biological chemistry 20041217
The beta-amyloid precursor protein controls a store-operated Ca2+ entry in cortical neurons. The European journal of neuroscience 20041001
3-nitrocoumarins as dienophiles in the Diels-Alder reaction in water. An approach to the synthesis of nitrotetrahydrobenzo[c]chromenones and dihydrodibenzo[b,d]furans. The Journal of organic chemistry 20031128
Phospholipase C-gamma modulates epithelial tight junction permeability through hyperphosphorylation of tight junction proteins. The Journal of biological chemistry 20020920
Phospholipase C is required for glucose-induced calcium influx in budding yeast. FEBS letters 20020605
3-Nitrocoumarin is an efficient inhibitor of budding yeast phospholipase-C. Cell biochemistry and function 20011201
PtdIns(4,5)P(2) and phospholipase C-independent Ins(1,4,5)P(3) signals induced by a nitrogen source in nitrogen-starved yeast cells. The Biochemical journal 20011101
Properties