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143334-83-2

143334-83-2 | N1-[2-(3-nitrophenyl)-2,3-dihydro-1H-isoindol-1-yliden]-3-nitroaniline

CAS No: 143334-83-2 Catalog No: AG01CAYR MDL No:MFCD00220116

Product Description

Catalog Number:
AG01CAYR
Chemical Name:
N1-[2-(3-nitrophenyl)-2,3-dihydro-1H-isoindol-1-yliden]-3-nitroaniline
CAS Number:
143334-83-2
Molecular Formula:
C20H14N4O4
Molecular Weight:
374.3496
MDL Number:
MFCD00220116
IUPAC Name:
N,2-bis(3-nitrophenyl)-3H-isoindol-1-imine
InChI:
InChI=1S/C20H14N4O4/c25-23(26)17-8-3-6-15(11-17)21-20-19-10-2-1-5-14(19)13-22(20)16-7-4-9-18(12-16)24(27)28/h1-12H,13H2
InChI Key:
JVKIXVZIUPLZQK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)/N=C\1/N(Cc2c1cccc2)c1cccc(c1)[N+](=O)[O-]
NSC Number:
657193

Properties

Complexity:
629  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.102g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.356g/mol
Monoisotopic Mass:
374.102g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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