Isopropyl-4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate-1,1-dioxide
Grundinformationen
- CAS
118854-48-1- Standard-SMILES
CC(C)OC(=O)C1=C(O)c2ccccc2S(=O)(=O)N1C- InChIKey
ZHWSBDIYCSOTBY-UHFFFAOYSA-N- Summenformel
- C13H15NO5S
- Durchschnittliche Molmasse
- 297,33 g/mol
Namen und Bezeichner
- Bevorzugter Name
- Isopropyl-4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate-1,1-dioxide
- IUPAC
- propan-2-yl 4-hydroxy-2-methyl-1,1-dioxo-1λ6,2-benzothiazine-3-carboxylate
- Englischer Name
- 4-Hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylic acid isopropyl ester 1,1-dioxide
- Summenformel
- C13H15NO5S
- Molmasse
- 297.33
Namen und Synonyme
118854-48-1Isopropyl-4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate-1,1-dioxideMeloxicam impurity F7EFQ1F465LMeloxicam impurity F [EP]UNII-7EFQ1F465LMELOXICAM IMPURITY F [EP IMPURITY]PIROXICAM IMPURITY L [EP IMPURITY]MELOXICAM IMPURITY F (EP IMPURITY)PIROXICAM IMPURITY L (EP IMPURITY)RefChem:201307Isopropyl 4-hydroxy-2-methyl-2H-benzo[e][1,2]thiazine-3-carboxylate 1,1-dioxide
Weitere Namen anzeigen
Piroxicam EP IMP LPiroxicaM iMpurity LMeloxicam Impurity F(EP)Meloxicam EP Impurity F(EP)Isopropyl 4-Hydroxy-2-methyl-Meloxicam USP Related Compound C1-Methylethyl 4-Hydroxy-2-methyl-2HMeloxicam EP Impurity F (Piroxicam EP Impurity L)Piroxicam EP Impurity L (Meloxicam EP Impurity F)
Isopropyl 4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxideNSC640233NSC-640233Isopropyl 4-Hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate 1,1-Dioxide (Piroxicam Impurity L)1-Methylethyl 4-Hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylate 1,1-Dioxidepropan-2-yl 4-hydroxy-2-methyl-1,1-dioxo-1lambda6,2-benzothiazine-3-carboxylate2H-1,2-Benzothiazine-3-carboxylic acid, 4-hydroxy-2-methyl-, 1-methylethyl ester, 1,1-dioxideMeloxicam EP Impurity F;<br>Piroxicam EP Impurity L
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,6
- Polarare Oberfläche (TPSA)
- 92,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 531
Physikochemische Eigenschaften
- Schmelzpunkt
- 200 °C · 200 °C
- Siedepunkt
- 450.5 · 450.5±55.0 °C(Predicted)
- Dichte
- 1.408 · 1.408
- storage temp.
- -20 °C · -20°C Freezer, Under inert atmosphere
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 4.5 · 4.50±1.00(Predicted)
- Farbe
- White to Off-White
- Major Application
- pharmaceutical
- InChI
- 1S/C13H15NO5S/c1-8(2)19-13(16)11-12(15)9-6-4-5-7-10(9)20(17,18)14(11)3/h4-8,15H,1-3H3
- InChIKey
- ZHWSBDIYCSOTBY-UHFFFAOYSA-N
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (95.1%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 19-06-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/31232
Hazard Classes and CategoriesSkin Irrit. 2 (95.1%)
Sicherheitsdaten
- wgk
- WGK 3
- hs_code
- 2934990002
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
- Speicherklasse
- 6.1D - Non-combustible acute toxic Cat.3toxic hazardous materials or hazardous materials causing chronic effects
- Hazard Classifications
- Acute Tox. 3 Oral
Chemie und Industrie
Vor- und nachgelagerte Produkte
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