Indomethacin | CAS No. 53-86-1

Indomethacin

Basic Information

CAS Number

53-86-1

Molecular Formula

C19H16ClNO4

Molecular Weight

357.79 g/mol

AD

Basic Physical Properties

Melting Point

155-162?°C

Boiling Point

499.4°C at 760 mmHg

Water Solubility

Soluble in acetone (40 mg/mL - clear, yellow solution), ethanol (20 mg/mL), ether, castor oil; Soluble in chloroform (50 mg/mL - clear, yellow, extremely viscous solution); decomposed by strong alkali but stable in neutral or slightly acidic media; insoluble in water.

Flash Point

255.8°C

Solubility

ethanol: 50 mg/mL, clear, yellow-green

Refractive Index

1.6800 (estimate)

Vapor Pressure

8.61E-11mmHg at 25°C

COc1ccc2c(c1)c(CC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C

InChI

InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)

InChIKey

CGIGDMFJXJATDK-UHFFFAOYSA-N

LogP

3.9273200000000026

pKa

4.5(at 25℃)

Topological Polar Surface Area

68.53 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

506

Safety Information

View Safety Information

GHS Hazard Pictograms

H300H300

Hazard Statement

H300 Fatal if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Toxicity

LD50 i.p. in rats: 13 mg/kg (Klaassen)

Synonyms & References

English

  • Indomethacin
  • indomethacin methanol solution
  • indomethacin crystalline
  • indomethacin usp
  • indometacin
  • 1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-ylacetic acid
  • INDOMETACIN POTASSIUM
  • 2-(1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetic acid
  • 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-3-indoleacetic Acid
  • 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid
  • 吲哚美辛
  • Indocin
  • Indometacine
  • Indomethacine
  • Indocid
  • Metindol
  • Indomethazine
  • Imbrilon
  • Amuno
  • Tannex
  • Indomethacinum
  • Mikametan
  • Methazine
  • Indoptol
  • Confortid
  • Artracin
  • Inflazon
  • Indomecol
  • Metartril
  • Infrocin
  • Indoptic

MDL Number

MFCD00057095

Customs Code

2933290090

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