MedKoo Cat#: 414665 | Name: Oxetorone Free Base

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Oxetorone Free Base is used in the treatment of migraine.

Chemical Structure

Oxetorone Free Base
Oxetorone Free Base
CAS#26020-55-3 (free base)

Theoretical Analysis

MedKoo Cat#: 414665

Name: Oxetorone Free Base

CAS#: 26020-55-3 (free base)

Chemical Formula: C21H21NO2

Exact Mass: 319.1572

Molecular Weight: 319.40

Elemental Analysis: C, 78.97; H, 6.63; N, 4.39; O, 10.02

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
26020-55-3 (free base); 34522-46-8 (fumarate)
Synonym
Oxetorone Free Base; Oxetorona; Oxetoronum
IUPAC/Chemical Name
3-(12H-Benzofuro(3,2-c)(1)benzoxepin-6-yliden)-N,N-dimethylpropylamin
InChi Key
VZVRZTZPHOHSCK-LICLKQGHSA-N
InChi Code
InChI=1S/C21H21NO2/c1-22(2)13-7-10-17-15-8-3-5-11-19(15)23-14-18-16-9-4-6-12-20(16)24-21(17)18/h3-6,8-12H,7,13-14H2,1-2H3/b17-10+
SMILES Code
CN(C)CC/C=C1C(OC2=CC=CC=C23)=C3COC4=CC=CC=C/14
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 319.40 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Macaigne G, Boivin JF, Chayette C, Cheaib S, Deplus R. Colite lymphocytaire associée à la prise d'oxétorone [Oxetorone-associated lymphocytic colitis]. Gastroenterol Clin Biol. 2002 May;26(5):537. French. PMID: 12122372. 2: Deguigne M, Bruneau C, Touré A, Turcant A, Le Roux G. New evidence for oxetorone toxicity. Clin Toxicol (Phila). 2017 Feb;55(2):142-146. doi: 10.1080/15563650.2016.1267358. Epub 2016 Dec 14. PMID: 27967233. 3: Pradalier A, Molitor JL, Campinos C. Oxétorone et sueurs profuses [Oxetorone and profuse sweating]. Therapie. 2003 Mar-Apr;58(2):166-7. French. doi: 10.2515/therapie:2003025. PMID: 12942859. 4: Payen C, Patat AM, Pulce C, Descotes J. Intoxication aiguë par oxetorone [Acute poisoning with oxetorone]. Therapie. 2006 Nov-Dec;61(6):548-50. French. doi: 10.2515/therapie:2006081. PMID: 17348615. 5: Pradalier A. Hyperprolactinaemia and depression induced by oxetorone. Cephalalgia. 1996 Dec;16(8):560-1. doi: 10.1046/j.1468-2982.1996.1608560.x. PMID: 8980859. 6: Fathallah N, Chatti S, Azouz MM. Colite lymphocytaire associée à la prise d'oxétorone [Lymphocytic colitis associated with oxetorone consumption]. Gastroenterol Clin Biol. 2010 Feb;34(2):154-5. French. doi: 10.1016/j.gcb.2009.12.001. Epub 2010 Jan 21. PMID: 20096517. 7: Galerneau V, Petit J, Deghmani M, Leroy J, Droy JM, Leroy A, Oksenhendler G, Winckler C. Severe self-poisoning with oxetorone: report of one case. J Toxicol Clin Toxicol. 1990;28(1):111-6. doi: 10.3109/15563659008993482. PMID: 2381017. 8: Roos C. Migraine : données épidémiologiques, cliniques et thérapeutiques [Migraine epidemiological, clinical and therapeutic data]. Biol Aujourdhui. 2019;213(1-2):35-41. French. doi: 10.1051/jbio/2019019. Epub 2019 Jul 5. PMID: 31274101. 9: Barchewitz G, Vernant C, Mazue G, Binon F, Cier A, Tuchmann Duplessis H. Oxetorone-induced hyperprogesteronemia and the development of uterine decidual lesions in rats. Arzneimittelforschung. 1984;34(9):1007-10. PMID: 6542368. 10: de Coster J. Etude de l'oxétorone dans les céphalées migraineuses [Oxetorone in the treatment of migrainous cephalalgia (author's transl)]. Schweiz Rundsch Med Prax. 1976 Jul 13;65(28):879-82. French. PMID: 1005299.