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400878-25-3

400878-25-3 structural image
Product Name: 2-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)BENZENECARBOXYLIC ACID
Formula: C11H13NO4S
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

COMPUTED DESCRIPTORS

Molecular Weight 255.29 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 255.05652907 g/mol
Monoisotopic Mass 255.05652907 g/mol
Topological Polar Surface Area 83.1 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 373
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