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143583-67-9

143583-67-9 | 1H-Isoindole-1,3(2H)-dione, 2-(2-acetylphenyl)-4-nitro-

CAS No: 143583-67-9 Catalog No: AG007JY5 MDL No:

Product Description

Catalog Number:
AG007JY5
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(2-acetylphenyl)-4-nitro-
CAS Number:
143583-67-9
Molecular Formula:
C16H10N2O5
Molecular Weight:
310.2610
IUPAC Name:
2-(2-acetylphenyl)-4-nitroisoindole-1,3-dione
InChI:
InChI=1S/C16H10N2O5/c1-9(19)10-5-2-3-7-12(10)17-15(20)11-6-4-8-13(18(22)23)14(11)16(17)21/h2-8H,1H3
InChI Key:
BNHMEMWKGXIWGO-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccccc1N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

Properties

Complexity:
555  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.059g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.265g/mol
Monoisotopic Mass:
310.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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