MedKoo Cat#: 464712 | Name: Brombuterol HCl
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Description:

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

Brombuterol is an agonist of the β2-adrenergic receptor (β2-AR). It has been used as an illicit feed additive to increase the muscle-to-fat ratio of livestock.

Chemical Structure

Brombuterol HCl
Brombuterol HCl
CAS#21912-49-2 (HCl)

Theoretical Analysis

MedKoo Cat#: 464712

Name: Brombuterol HCl

CAS#: 21912-49-2 (HCl)

Chemical Formula: C12H19Br2ClN2O

Exact Mass: 399.9553

Molecular Weight: 402.56

Elemental Analysis: C, 35.80; H, 4.76; Br, 39.70; Cl, 8.81; N, 6.96; O, 3.97

Price and Availability

Size Price Availability Quantity
5mg USD 385.00 2 Weeks
10mg USD 700.00 2 Weeks
25mg USD 1,250.00 2 Weeks
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Related CAS #
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Synonym
Brombuterol HCl; Brombuterol hydrochloride;
IUPAC/Chemical Name
1-(4-amino-3,5-dibromophenyl)-2-(tert-butylamino)ethan-1-ol hydrochloride
InChi Key
XGPFKIAOVSGRSY-UHFFFAOYSA-N
InChi Code
InChI=1S/C12H18Br2N2O.ClH/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7;/h4-5,10,16-17H,6,15H2,1-3H3;1H
SMILES Code
BrC1=C(C(Br)=CC(C(O)CNC(C)(C)C)=C1)N.Cl
Appearance
Solid powder
Purity
>95% (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 402.56 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: Gogolashvili A, Tatunashvili E, Chankvetadze L, Sohajda T, Gumustas M, Ozkan SA, Salgado A, Chankvetadze B. Separation of brombuterol enantiomers in capillary electrophoresis with cyclodextrin-type chiral selectors and investigation of structure of selector-selectand complexes using nuclear magnetic resonance spectroscopy. Electrophoresis. 2019 Aug;40(15):1904-1912. doi: 10.1002/elps.201900062. Epub 2019 Apr 4. PMID: 30900263. 2: Li P, Ma G, Wu K, Deng A, Li J. An electrochemiluminescence energy resonance transfer system for highly sensitive detection of brombuterol. Talanta. 2021 Feb 1;223(Pt 1):121687. doi: 10.1016/j.talanta.2020.121687. Epub 2020 Sep 25. PMID: 33303140. 3: Huang W , Guo E , Li J , Deng A . Quantitative and ultrasensitive detection of brombuterol by a surface-enhanced Raman scattering (SERS)-based lateral flow immunochromatographic assay (FLIA) using AgMBA@Au-Ab as an immunoprobe. Analyst. 2021 Jan 4;146(1):296-304. doi: 10.1039/d0an01949f. PMID: 33146162. 4: Dong T, Hu L, Zhao K, Deng A, Li J. Multiple signal amplified electrochemiluminescent immunoassay for brombuterol detection using gold nanoparticles and polyamidoamine dendrimers-silver nanoribbon. Anal Chim Acta. 2016 Nov 16;945:85-94. doi: 10.1016/j.aca.2016.10.006. Epub 2016 Oct 14. PMID: 27968719. 5: Zhu Q, Cai F, Zhang J, Zhao K, Deng A, Li J. Highly sensitive electrochemiluminescent immunosensor based on gold nanoparticles-functionalized zinc oxide nanorod and poly(amidoamine)-graphene for detecting brombuterol. Biosens Bioelectron. 2016 Dec 15;86:899-906. doi: 10.1016/j.bios.2016.07.091. Epub 2016 Jul 29. PMID: 27497196. 6: Sangiorgi E, Curatolo M. Application of a sequential analytical procedure for the detection of the beta-agonist brombuterol in bovine urine samples. J Chromatogr B Biomed Sci Appl. 1997 Jun 6;693(2):468-78. doi: 10.1016/s0378-4347(97)00056-x. PMID: 9210454. 7: Koster EH, Crescenzi C, den Hoedt W, Ensing K, de Jong GJ. Fibers coated with molecularly imprinted polymers for solid-phase microextraction. Anal Chem. 2001 Jul 1;73(13):3140-5. doi: 10.1021/ac001331x. PMID: 11467565. 8: Mastrianni KR, Metavarayuth K, Brewer WE, Wang Q. Analysis of 10 β-agonists in pork meat using automated dispersive pipette extraction and LC-MS/MS. J Chromatogr B Analyt Technol Biomed Life Sci. 2018 May 1;1084:64-68. doi: 10.1016/j.jchromb.2018.03.026. Epub 2018 Mar 14. PMID: 29571118. 9: Tang J, Wang J, Shi S, Hu S, Yuan L. Determination of β-Agonist Residues in Animal-Derived Food by a Liquid Chromatography-Tandem Mass Spectrometric Method Combined with Molecularly Imprinted Stir Bar Sorptive Extraction. J Anal Methods Chem. 2018 Jun 25;2018:9053561. doi: 10.1155/2018/9053561. PMID: 30046508; PMCID: PMC6036788. 10: Wang R, Zhang W, Wang P, Su X. A paper-based competitive lateral flow immunoassay for multi β-agonist residues by using a single monoclonal antibody labelled with red fluorescent nanoparticles. Mikrochim Acta. 2018;185(3):191. doi: 10.1007/s00604-018-2730-9. Epub 2018 Feb 22. PMID: 29503465; PMCID: PMC5823949. 11: Chu L, Zheng S, Qu B, Geng S, Kang X. Detection of β-agonists in pork tissue with novel electrospun nanofibers-based solid-phase extraction followed ultra- high performance liquid chromatography/tandem mass spectrometry. Food Chem. 2017 Jul 15;227:315-321. doi: 10.1016/j.foodchem.2017.01.059. Epub 2017 Jan 16. PMID: 28274437. 12: Ren Z, Chen Y, Wang J, Zheng P, Zhang H, Jiang H. A highly specific and sensitive indirect competitive monoclonal ELISA for the detection of brombuterol in animal feed, swine urine, pork and liver samples. Food Addit Contam Part A Chem Anal Control Expo Risk Assess. 2021 Apr;38(4):586-593. doi: 10.1080/19440049.2021.1877835. Epub 2021 Feb 17. PMID: 33596157. 13: Suo DC, Zhao GL, Wang PL, Su XO. Simultaneous determination of β-agonists and psychiatric drugs in feeds by LC-MS-MS. J Chromatogr Sci. 2014 Aug;52(7):604-8. doi: 10.1093/chromsci/bmt084. Epub 2013 Jun 30. PMID: 23817171. 14: Xu J, Xu S, Xiao Y, Chingin K, Lu H, Yan R, Chen H. Quantitative Determination of Bulk Molecular Concentrations of β-Agonists in Pork Tissue Samples by Direct Internal Extractive Electrospray Ionization-Mass Spectrometry. Anal Chem. 2017 Nov 7;89(21):11252-11258. doi: 10.1021/acs.analchem.7b00517. Epub 2017 Oct 26. PMID: 28988472. 15: Wu K, Guo L, Xu W, Xu H, Aguilar ZP, Xu G, Lai W, Xiong Y, Wan Y. Sulfonated polystyrene magnetic nanobeads coupled with immunochromatographic strip for clenbuterol determination in pork muscle. Talanta. 2014 Nov;129:431-7. doi: 10.1016/j.talanta.2014.06.007. Epub 2014 Jun 14. PMID: 25127616. 16: Xu W, Chen X, Huang X, Yang W, Liu C, Lai W, Xu H, Xiong Y. Ru(phen)3(2+) doped silica nanoparticle based immunochromatographic strip for rapid quantitative detection of β-agonist residues in swine urine. Talanta. 2013 Sep 30;114:160-6. doi: 10.1016/j.talanta.2013.04.013. Epub 2013 Apr 12. PMID: 23953456. 17: Wang P, Liu X, Su X, Zhu R. Sensitive detection of β-agonists in pork tissue with novel molecularly imprinted polymer extraction followed liquid chromatography coupled tandem mass spectrometry detection. Food Chem. 2015 Oct 1;184:72-9. doi: 10.1016/j.foodchem.2015.03.073. Epub 2015 Mar 26. PMID: 25872428. 18: Moragues F, Igualada C. How to decrease ion suppression in a multiresidue determination of beta-agonists in animal liver and urine by liquid chromatography-mass spectrometry with ion-trap detector. Anal Chim Acta. 2009 Apr 1;637(1-2):193-5. doi: 10.1016/j.aca.2008.10.065. Epub 2008 Nov 5. PMID: 19286029. 19: Widstrand C, Larsson F, Fiori M, Civitareale C, Mirante S, Brambilla G. Evaluation of MISPE for the multi-residue extraction of beta-agonists from calves urine. J Chromatogr B Analyt Technol Biomed Life Sci. 2004 May 5;804(1):85-91. doi: 10.1016/j.jchromb.2003.12.034. PMID: 15093162. 20: Nie J, Zhu M, Lian J, Pan Y, Deng X, Hu C. [Determination of fifteen beta- agonists in animal urine by high performance liquid chromatography-tandem mass spectrometry]. Se Pu. 2010 Aug;28(8):759-64. Chinese. doi: 10.3724/sp.j.1123.2010.00759. PMID: 21261043.