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89303-32-2

89303-32-2 | Benzene, 2-nitro-1-phenoxy-3-[(phenylsulfonyl)methyl]-

CAS No: 89303-32-2 Catalog No: AG0040GG MDL No:

Product Description

Catalog Number:
AG0040GG
Chemical Name:
Benzene, 2-nitro-1-phenoxy-3-[(phenylsulfonyl)methyl]-
CAS Number:
89303-32-2
Molecular Formula:
C19H15NO5S
Molecular Weight:
369.3911
IUPAC Name:
1-(benzenesulfonylmethyl)-2-nitro-3-phenoxybenzene
InChI:
InChI=1S/C19H15NO5S/c21-20(22)19-15(14-26(23,24)17-11-5-2-6-12-17)8-7-13-18(19)25-16-9-3-1-4-10-16/h1-13H,14H2
InChI Key:
DBBAJUHGLMTTQU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(cccc1CS(=O)(=O)c1ccccc1)Oc1ccccc1

Properties

Complexity:
556  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.067g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.391g/mol
Monoisotopic Mass:
369.067g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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