Chemical Properties of Indomethacin (CAS 53-86-1)

Indomethacin

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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)
InChI Key
CGIGDMFJXJATDK-UHFFFAOYSA-N
Formula
C19H16ClNO4
SMILES
COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
Molecular Weight1
357.79
CAS
53-86-1
Other Names
  • (1-p-Chlorobenzoyl-5-methoxy-2-methylindol-3-yl)acetic acid
  • 1-(4-Chlorobenzoyl)-2-methyl-5-methoxyindole-3-acetic acid
  • 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-acetic acid (indomethacin)
  • 1-(4-Chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic acid
  • 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid
  • 1-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indole-acetic acid
  • 1-(p-Chlorobenzoyl)-2-methyl-5-methoxyindole-3-acetic acid
  • 1-(p-Chlorobenzoyl)-5-methoxy-2-methyl-3-indolylacetic acid
  • 1-(p-Chlorobenzoyl)-5-methoxy-2-methylindol-3-acetic acid
  • 1-(p-Chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic acid
  • 1-p-Cloro-benzoil-5-metoxi-2-metilindol-3-acido acetico
  • 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-
  • 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
  • Amuno
  • Argun
  • Artracin
  • Artrinovo
  • Artrivia
  • Bonidin
  • Catlep
  • Chibro-amuno
  • Chrono-indicid
  • Confortid
  • Dolcidium
  • Dolovin
  • Durametacin
  • Elmetacin
  • Idomethine
  • Imbrilon
  • Inacid
  • Indacin
  • Indo-Rectolmin
  • Indo-phlogont
  • Indo-tablinen
  • Indocid
  • Indocin
  • Indocollyre
  • Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-
  • Indomecol
  • Indomed
  • Indomee
  • Indometacin
  • Indometacine
  • Indometacyna
  • Indomethacine
  • Indomethazine
  • Indomethine
  • Indometicina
  • Indomod
  • Indonol
  • Indoptic
  • Indoptol
  • Indorektal
  • Indoxen
  • Inflazon
  • Infrocin
  • Innamit
  • Inteban
  • Inteban sp
  • Kwas 1-(p-chlorobenzoilo)-2-metylo-5-metoksy-3-indolilooctowy
  • Lausit
  • Metacen
  • Metartril
  • Methazine
  • Metindol
  • Mezolin
  • Miametan
  • Mikametan
  • Mobilan
  • N-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indolylacetic acid
  • N-p-Chlorbenzoyl-5-methoxy-2-methylindole-3-acetic acid
  • NCI-C56144
  • Reumacide
  • Rheumacin LA
  • Sadoreum
  • Tannex
  • Vonum
  • «alpha»-(1-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indolyl)acetic acid
  • «alpha»-(1-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indolyl)acetic acid
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Physical Properties

Property Value Unit Source
Δfus 55.10 kJ/mol Thermod...
log10WS [-4.69; -2.94]   Show Hide
log10WS -4.69 Aq. Sol...
log10WS -2.94 Aq. Sol...
logPoct/wat 3.927 Crippen Calculated Property
McVol 252.990 ml/mol McGowan Calculated Property
Inp [2680.00; 2685.00]   Show Hide
Inp 2680.00 NIST
Inp 2685.00 NIST
Inp 2680.00 NIST
Tfus [432.10; 433.60] K Show Hide
Tfus 432.10 K Aq. Sol...
Tfus 432.10 K Aq. Sol...
Tfus 433.60 K Solubil...
Tfus 433.10 K (Solid ...
Tfus 433.00 ± 1.00 K NIST

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH [36.49; 43.50] kJ/mol [433.00; 435.20] Show Hide
ΔfusH 37.90 kJ/mol 433.00 NIST
ΔfusH 37.80 kJ/mol 433.00 NIST
ΔfusH 39.99 kJ/mol 434.00 NIST
ΔfusH 43.50 kJ/mol 434.50 NIST
ΔfusH 36.50 kJ/mol 435.20 NIST
ΔfusH 36.49 kJ/mol 435.20 NIST

Similar Compounds

Indomethacin, methyl ester. Indometacin, methylated. Indometacin, hydroxy, bis-methylated. Indomethacin, ethyl ester. Indomethacin, TBDMS. Indomethacin, isobutyl ester. Indomethacin, pentyl ester. Yohimbine. Ibogaine. Pholcodine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine. Codeine-propionyl.

Find more compounds similar to Indomethacin.

Mixtures

Find more mixtures with Indomethacin.

Sources

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