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2882-15-7

2882-15-7 structural image
Product Name: 5-METHOXY-2-METHYL-3-INDOLEACETIC ACID
Formula: C12H13NO3
Synonyms: N-Des(4-chlorobenzoyl)indomethacin;2-(5-Methoxy-2-methyl-1H-indol-3-yl)acetic acid;5-Methoxy-2-methyl-3-indoleacetic acid;NSC 97026
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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 P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
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 219.24 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 219.08954328 g/mol
Monoisotopic Mass 219.08954328 g/mol
Topological Polar Surface Area 62.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 269
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

N-Deschlorobenzoyl indomethacin is a member of indole-3-acetic acids.