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138-42-1

138-42-1 structural image
Product Name: 4-NITROBENZENESULFONIC ACID
Formula: C6H5NO5S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Nearly white solid; [Acros Organics MSDS]
Chemical Classes Nitrogen Compounds -> Nitrobenzesulfonic Acids

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H314:Skin corrosion/irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P309+P311:IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 203.17 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 202.98884343 g/mol
Monoisotopic Mass 202.98884343 g/mol
Topological Polar Surface Area 109 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 279
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes