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MedKoo Cat#: 150101 | Name: tert-Butyl peroxybenzoate

Description:

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

tert-Butyl peroxybenzoate is a highly selective Muscarinic M1 receptor allosteric agonist. It activates M1 through an allosteric site.

Chemical Structure

tert-Butyl peroxybenzoate
tert-Butyl peroxybenzoate
CAS#614-45-9

Theoretical Analysis

MedKoo Cat#: 150101

Name: tert-Butyl peroxybenzoate

CAS#: 614-45-9

Chemical Formula: C11H14O3

Exact Mass: 194.0940

Molecular Weight: 194.23

Elemental Analysis: C, 68.02; H, 7.27; O, 24.71

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 #
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Synonym
tert-Butyl peroxybenzoate; tert-Butyl perbenzoate; tert-butyl benzenecarboperoxoate; t-Butyl perbenzoate;
IUPAC/Chemical Name
tert-butyl benzenecarboperoxoate
InChi Key
GJBRNHKUVLOCEB-UHFFFAOYSA-N
InChi Code
1S/C11H14O3/c1-11(2,3)14-13-10(12)9-7-5-4-6-8-9/h4-8H,1-3H3
SMILES Code
O=C(C1=CC=CC=C1)OOC(C)(C)C
Appearance
To be determined
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 194.23 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: Guo S, Wang Q, Jiang Y, Yu JT. tert-Butyl peroxybenzoate-promoted α-methylation of 1,3-dicarbonyl compounds. J Org Chem. 2014 Nov 21;79(22):11285-9. doi: 10.1021/jo502204a. Epub 2014 Oct 31. PMID: 25331571. 2: Cao JJ, Zhu TH, Wang SY, Gu ZY, Wang X, Ji SJ. tert-Butyl peroxybenzoate (TBPB)-mediated 2-isocyanobiaryl insertion with 1,4-dioxane: efficient synthesis of 6-alkyl phenanthridines via C(sp3)-H/C(sp2)-H bond functionalization. Chem Commun (Camb). 2014 Jun 21;50(49):6439-42. doi: 10.1039/c4cc00743c. Epub 2014 Apr 4. PMID: 24699898.