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5401-94-5

5401-94-5 structural image
Product Name: 5-Nitroindazole
Formula: C7H5N3O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Yellow odorless powder; [Eastman Kodak MSDS]
Solubility 14.2 [ug/mL] (The mean of the results at pH 7.4)
Vapor Pressure 0.0000128 [mmHg]
Chemical Classes Nitrogen Compounds -> Other Nitrogen Rings

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08
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
H341:Germ cell mutagenicity
Precautionary Statement Codes P201:Obtain special instructions before use.
P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 163.13 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 163.038176411 g/mol
Monoisotopic Mass 163.038176411 g/mol
Topological Polar Surface Area 74.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 192
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

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