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271-44-3

271-44-3 structural image
Product Name: Indazole
Formula: C7H6N2
Synonyms: 1,2-Benzodiazole;1,2-Benzopyrazole
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid; [Merck Index] White crystalline powder; [Alfa Aesar MSDS]
Vapor Pressure 0.00148 [mmHg]
Ionization Efficiency Positive
Kovats Retention Index 1260
Chemical Classes Nitrogen Compounds -> Other Nitrogen Rings

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
H332:Acute toxicity,inhalation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes 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.

COMPUTED DESCRIPTORS

Molecular Weight 118.14 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 118.053098200 g/mol
Monoisotopic Mass 118.053098200 g/mol
Topological Polar Surface Area 28.7 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 103
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

PRODUCT INTRODUCTION

description

1H-indazole is an indazole. It is a tautomer of a 2H-indazole.