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111795-99-4

111795-99-4 structural image
Product Name: 2-CYANOMETHYL-3-NITRO-6-METHOXY PYRIDINE
Formula: C8H7N3O3
Synonyms: (6-Methoxy-3-nitro-2-pyridyl)acetonitrile
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H301:Acute toxicity,oral
H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 193.16 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 193.04874109 g/mol
Monoisotopic Mass 193.04874109 g/mol
Topological Polar Surface Area 91.7 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 254
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