Home Other Building Blocks 1-(5-Nitroindolin-1-yl)ethanone

1-(5-Nitroindolin-1-yl)ethanone

CAS No.:
33632-27-8
Catalog Number:
AG003D1N
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
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Product Description
Catalog Number:
AG003D1N
Chemical Name:
1-(5-Nitroindolin-1-yl)ethanone
CAS Number:
33632-27-8
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD00005811
IUPAC Name:
1-(5-nitro-2,3-dihydroindol-1-yl)ethanone
InChI:
InChI=1S/C10H10N2O3/c1-7(13)11-5-4-8-6-9(12(14)15)2-3-10(8)11/h2-3,6H,4-5H2,1H3
InChI Key:
OJKKTNFCWMBYMT-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCc2c1ccc(c2)[N+](=O)[O-]
EC Number:
251-609-5
NSC Number:
87626
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
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