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MedKoo Cat#: 582046 | Name: Dechlorane 603

Description:

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

Dechlorane 603 is a chlorinated polycyclic compound that acts as an antioxidant with prolonged thermal stability.

Chemical Structure

Dechlorane 603
Dechlorane 603
CAS#13560-92-4

Theoretical Analysis

MedKoo Cat#: 582046

Name: Dechlorane 603

CAS#: 13560-92-4

Chemical Formula: C17H8Cl12

Exact Mass: 631.6900

Molecular Weight: 637.65

Elemental Analysis: C, 32.02; H, 1.26; Cl, 66.71

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Related CAS #
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Synonym
Dechlorane 603; AI3-27886.
IUPAC/Chemical Name
1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,5,6,7,8,12,12,13,13-dodecachloro-1,4,4a,5,8,8a,9,9a,10,10a-decahydro-
InChi Key
WSEXCYJMFQVEIN-UHFFFAOYSA-N
InChi Code
InChI=1S/C17H8Cl12/c18-8-10(20)14(24)6-3-1-2(4(6)12(8,22)16(14,26)27)5-7(3)15(25)11(21)9(19)13(5,23)17(15,28)29/h2-7H,1H2
SMILES Code
ClC1(Cl)C2(Cl)C(Cl)=C(Cl)C1(Cl)C3C4C5C(C6(Cl)Cl)(Cl)C(Cl)=C(Cl)C6(Cl)C5C(C4)C32
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
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
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 637.65 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: Pizzochero AC, de la Torre A, Sanz P, Navarro I, Michel LN, Lepoint G, Das K, Schnitzler JG, Chenery SR, McCarthy ID, Malm O, Dorneles PR, Martínez MÁ. Occurrence of legacy and emerging organic pollutants in whitemouth croakers from Southeastern Brazil. Sci Total Environ. 2019 Sep 10;682:719-728. doi: 10.1016/j.scitotenv.2019.05.213. Epub 2019 May 17. PubMed PMID: 31129551. 2: Liu X, Wu Y, Zhang X, Shen L, Brazeau AL, Adams DH, Marler H, Watts BD, Chen D. Novel Dechlorane Analogues and Possible Sources in Peregrine Falcon Eggs and Shark Livers from the Western North Atlantic Regions. Environ Sci Technol. 2019 Apr 2;53(7):3419-3428. doi: 10.1021/acs.est.8b06214. Epub 2019 Mar 19. PubMed PMID: 30852890. 3: Chen X, Zhu Y, Huang Q, Liu J, Liu B, Zhang Y. Distributions, influencing factors, and risk assessment of Dechlorane Plus and related compounds in surficial water and sediment from the Jiulong River Estuary, Southeast China. Environ Sci Pollut Res Int. 2018 Oct;25(30):30292-30300. doi: 10.1007/s11356-018-2874-5. Epub 2018 Aug 29. PubMed PMID: 30159835. 4: Sales C, Poma G, Malarvannan G, Portolés T, Beltrán J, Covaci A. Simultaneous determination of dechloranes, polybrominated diphenyl ethers and novel brominated flame retardants in food and serum. Anal Bioanal Chem. 2017 Jul;409(19):4507-4515. doi: 10.1007/s00216-017-0411-x. Epub 2017 Jun 8. PubMed PMID: 28593372. 5: Guo J, Venier M, Salamova A, Hites RA. Bioaccumulation of Dechloranes, organophosphate esters, and other flame retardants in Great Lakes fish. Sci Total Environ. 2017 Apr 1;583:1-9. doi: 10.1016/j.scitotenv.2016.11.063. Epub 2017 Jan 20. PubMed PMID: 28110879. 6: Von Eyken A, Pijuan L, Martí R, Blanco MJ, Díaz-Ferrero J. Determination of Dechlorane Plus and related compounds (dechlorane 602, 603 and 604) in fish and vegetable oils. Chemosphere. 2016 Feb;144:1256-63. doi: 10.1016/j.chemosphere.2015.10.001. Epub 2015 Oct 23. PubMed PMID: 26476047. 7: Yang R, Zhang S, Li X, Luo D, Jing C. Dechloranes in lichens from the southeast Tibetan Plateau: Evidence of long-range atmospheric transport. Chemosphere. 2016 Feb;144:446-51. doi: 10.1016/j.chemosphere.2015.09.011. Epub 2015 Sep 18. PubMed PMID: 26386769. 8: L'Homme B, Calaprice C, Calvano CD, Zambonin C, Leardi R, Focant JF. Ultra-trace measurement of Dechloranes to investigate food as a route of human exposure. Chemosphere. 2015 Nov;139:525-33. doi: 10.1016/j.chemosphere.2015.07.043. Epub 2015 Aug 24. PubMed PMID: 26313934. 9: Tao W, Zhou Z, Shen L, Zhao B. Determination of dechlorane flame retardants in soil and fish at Guiyu, an electronic waste recycling site in south China. Environ Pollut. 2015 Nov;206:361-8. doi: 10.1016/j.envpol.2015.07.043. Epub 2015 Aug 1. PubMed PMID: 26241843. 10: Chen CL, Tsai DY, Ding WH. Optimisation of matrix solid-phase dispersion for the determination of Dechlorane compounds in marketed fish. Food Chem. 2014 Dec 1;164:286-92. doi: 10.1016/j.foodchem.2014.05.035. Epub 2014 May 20. PubMed PMID: 24996336. 11: Kim J, Son MH, Kim J, Suh J, Kang Y, Chang YS. Assessment of Dechlorane compounds in foodstuffs obtained from retail markets and estimates of dietary intake in Korean population. J Hazard Mater. 2014 Jun 30;275:19-25. doi: 10.1016/j.jhazmat.2014.04.032. Epub 2014 May 1. PubMed PMID: 24835686. 12: Barón E, Máñez M, Andreu AC, Sergio F, Hiraldo F, Eljarrat E, Barceló D. Bioaccumulation and biomagnification of emerging and classical flame retardants in bird eggs of 14 species from Doñana Natural Space and surrounding areas (South-western Spain). Environ Int. 2014 Jul;68:118-26. doi: 10.1016/j.envint.2014.03.013. Epub 2014 Apr 12. PubMed PMID: 24727066. 13: Peng H, Wan Y, Zhang K, Sun J, Hu J. Trophic transfer of dechloranes in the marine food web of Liaodong Bay, north China. Environ Sci Technol. 2014 May 20;48(10):5458-66. doi: 10.1021/es500229y. Epub 2014 May 12. PubMed PMID: 24702310. 14: Zhou SN, Siddique S, Lavoie L, Takser L, Abdelouahab N, Zhu J. Hexachloronorbornene-based flame retardants in humans: levels in maternal serum and milk. Environ Int. 2014 May;66:11-7. doi: 10.1016/j.envint.2014.01.010. Epub 2014 Feb 4. PubMed PMID: 24509140. 15: Barón E, Santín G, Eljarrat E, Barceló D. Occurrence of classic and emerging halogenated flame retardants in sediment and sludge from Ebro and Llobregat river basins (Spain). J Hazard Mater. 2014 Jan 30;265:288-95. doi: 10.1016/j.jhazmat.2013.10.069. Epub 2013 Nov 6. PubMed PMID: 24295901. 16: Sun J, Zhang A, Fang L, Wang J, Liu W. Levels and distribution of Dechlorane Plus and related compounds in surficial sediments of the Qiantang River in eastern China: the results of urbanization and tide. Sci Total Environ. 2013 Jan 15;443:194-9. doi: 10.1016/j.scitotenv.2012.10.096. Epub 2012 Nov 25. PubMed PMID: 23183230. 17: Sühring R, Möller A, Freese M, Pohlmann JD, Wolschke H, Sturm R, Xie Z, Hanel R, Ebinghaus R. Brominated flame retardants and dechloranes in eels from German Rivers. Chemosphere. 2013 Jan;90(1):118-24. doi: 10.1016/j.chemosphere.2012.08.016. Epub 2012 Sep 15. PubMed PMID: 22985592. 18: Peng H, Zhang K, Wan Y, Hu J. Tissue distribution, maternal transfer, and age-related accumulation of dechloranes in Chinese sturgeon. Environ Sci Technol. 2012 Sep 18;46(18):9907-13. doi: 10.1021/es3025879. Epub 2012 Sep 7. PubMed PMID: 22913883. 19: Wang L, Jia H, Liu X, Yang M, Hong W, Sun Y, Su Y, Qi H, Song W, Lin J, Li YF. Dechloranes in a river in northeastern China: spatial trends in multi-matrices and bioaccumulation in fish (Enchelyopus elongatus). Ecotoxicol Environ Saf. 2012 Oct;84:262-7. doi: 10.1016/j.ecoenv.2012.07.018. Epub 2012 Aug 3. PubMed PMID: 22863566. 20: Barón E, Eljarrat E, Barceló D. Analytical method for the determination of halogenated norbornene flame retardants in environmental and biota matrices by gas chromatography coupled to tandem mass spectrometry. J Chromatogr A. 2012 Jul 27;1248:154-60. doi: 10.1016/j.chroma.2012.05.079. Epub 2012 May 31. PubMed PMID: 22695692.

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PD119229

PD119229