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Home Nitros 4-(morpholin-4-yl)-3-nitro-2H-chromen-2-one

4-(morpholin-4-yl)-3-nitro-2H-chromen-2-one

CAS No.:
50527-34-9
Catalog Number:
AG019KAG
Molecular Formula:
C13H12N2O5
Molecular Weight:
276.2448
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Product Description
Catalog Number:
AG019KAG
Chemical Name:
4-(morpholin-4-yl)-3-nitro-2H-chromen-2-one
CAS Number:
50527-34-9
Molecular Formula:
C13H12N2O5
Molecular Weight:
276.2448
MDL Number:
MFCD00420263
IUPAC Name:
4-morpholin-4-yl-3-nitrochromen-2-one
InChI:
InChI=1S/C13H12N2O5/c16-13-12(15(17)18)11(14-5-7-19-8-6-14)9-3-1-2-4-10(9)20-13/h1-4H,5-8H2
InChI Key:
PYOMMFZCTIFHMA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(=O)oc2c(c1N1CCOCC1)cccc2
Properties
Complexity:
450  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.075g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.248g/mol
Monoisotopic Mass:
276.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
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