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671191-99-4

671191-99-4 structural image
Product Name: 1-(3-NITROPYRIDIN-2-YL)PIPERIDINE-4-CARBONITRILE
Formula: C11H12N4O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >34.8 [ug/mL] (The mean of the results at pH 7.4)

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 232.24 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 232.09602564 g/mol
Monoisotopic Mass 232.09602564 g/mol
Topological Polar Surface Area 85.7 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 324
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