1-(Methylsulfonyl)-3-Nitrobenzene
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Product Description
Product
1-(Methylsulfonyl)-3-Nitrobenzene
CAS
2976-32-1
Formula
C7H7NO4S
Synonym
Typical Product Specifications
SMILES
[N+]([O-])(=O)c1cc(S(=O)(=O)C)ccc1
InChI
FTJMAAWQEAOBBI-UHFFFAOYSA-N
InChIKey
1S/C7H7NO4S/c1-13(11,12)7-4-2-3-6(5-7)8(9)10/h2-5H,1H3
log P (octanol-water)
0.5
Vapor Pressure
3.39E-05 mm Hg
Water solubility
6580 mg/L
Atmospheric OH Rate Constant
1.11E-12 cm3/molecule-sec
Henry's Law Constant
4.92E-09 atm-m3/mole
Class
1-(Methylsulfonyl)-3-Nitrobenzene
Product Description
Product
1-(Methylsulfonyl)-3-Nitrobenzene
CAS
2976-32-1
Formula
C7H7NO4S
Synonym
Typical Product Specifications
SMILES
[N+]([O-])(=O)c1cc(S(=O)(=O)C)ccc1
InChI
FTJMAAWQEAOBBI-UHFFFAOYSA-N
InChIKey
1S/C7H7NO4S/c1-13(11,12)7-4-2-3-6(5-7)8(9)10/h2-5H,1H3
log P (octanol-water)
0.5
Vapor Pressure
3.39E-05 mm Hg
Water solubility
6580 mg/L
Atmospheric OH Rate Constant
1.11E-12 cm3/molecule-sec
Henry's Law Constant
4.92E-09 atm-m3/mole
Class
