6,11-Dihydro-11-oxodibenzo[b,e]oxepin-2-acetic Acid , 97% , 55453-87-7

Synonym(s):
(11-Oxo-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid;Isoxepac;NSC 300907

CAS NO.：55453-87-7

Empirical Formula: C16H12O4

Molecular Weight: 268.26

MDL number: MFCD00242952

EINECS: 611-268-9

PRODUCT Properties

• Melting point: 130-132°C
• Boiling point: 528.2±50.0 °C(Predicted)
• Density: 1.39 g/cm3
• storage temp.: Sealed in dry,Room Temperature
• solubility: soluble in Methanol
• form: Solid
• pka: 4.24±0.10(Predicted)
• color: White to Light yellow to Light orange
• Merck: 14,5237
• Major Application: pharmaceutical (small molecule)
• InChI: InChI=1S/C16H12O4/c17-15(18)8-10-5-6-14-13(7-10)16(19)12-4-2-1-3-11(12)9-20-14/h1-7H,8-9H2,(H,17,18)
• InChIKey: QFGMXJOBTNZHEL-UHFFFAOYSA-N
• SMILES: O1CC2=CC=CC=C2C(=O)C2=CC(CC(O)=O)=CC=C12
• CAS DataBase Reference: 55453-87-7(CAS DataBase Reference)

Description and Uses

Isoxepac is a non-steroidal anti-inflammatory with analgesic and antipyretic activity. It is more slowly absorbed and eliminated in the rat and rabbit after oral dosing than in the dog, rhesus monkey and man.It can be used to treat allergic rhinitis, urticaria, and skin diseases with itching symptoms.

Safety

• Symbol(GHS): GHS06
• Signal word: Danger
• Hazard statements: H301+H311-H315-H319
• Precautionary statements: P501-P270-P264-P280-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P405
• Hazard Codes: T
• Risk Statements: 25-62
• Safety Statements: 36/37-45
• RIDADR: UN 2811 6.1 / PGIII
• WGK Germany: WGK 3
• RTECS: HQ4110000
• HazardClass: 6.1
• PackingGroup: III
• HS Code: 2932996560
• Storage Class: 6.1C - Combustible acute toxic Cat.3; toxic compounds or compounds which causing chronic effects
• Hazard Classifications: Acute Tox. 3 Oral; Repr. 2; STOT RE 1
• Toxicity: LD50 orally in rats: 199 mg/kg (Ueno)