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493-52-7

493-52-7 structural image
Product Name: Methyl Red
Formula: C15H15N3O2
Synonyms: 2-(4-Dimethylaminophenylazo)benzoic acid;4-Dimethylaminoazobenzene-2′-carboxylic acid;Acid Red 2;Methyl red (C.I. 13020);Methyl red indicator solution
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Violet crystals; [Sax]
Color/Form GLISTENING, VIOLET CRYSTALS FROM TOLUENE
Melting Point 181-182 °C
Solubility ALMOST INSOL IN WATER; SOL IN ALC & ACETIC ACID
Vapor Pressure 0.00000014 [mmHg]
Dissociation Constants PKA1 2.5; PKA2 9.5; PKB 4.8
Chemical Classes Dyes -> Azo Dyes

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08
GHS Hazard Statements H225:Flammable liquids
H319:Serious eye damage/eye irritation
H371:Specific target organ toxicity, single exposure
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P337+P313:IF eye irritation persists: Get medical advice/attention.
P403+P235:Store in a well-ventilated place. Keep cool.

COMPUTED DESCRIPTORS

Molecular Weight 269.30 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 269.116426730 g/mol
Monoisotopic Mass 269.116426730 g/mol
Topological Polar Surface Area 65.3 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 349
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

Methyl red is an azo dye consisting of benzoic acid substituted at position 2 by a 4-[(dimethylamino)phenyl]diazenyl group. It has a role as a dye. It is a member of azobenzenes, a monocarboxylic acid and a tertiary amino compound. It is a conjugate acid of a methyl red(1-).

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