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· · COA & SDS available for every product · Same-day shipping on in-stock items BDE No 99 solution - 50 μg/mL in isooctane , CAS No.60348-60-9
GRADE & PURITY 50 μg/mL in isooctane
Synonyms
DTXSID9030048 | BDE 99 | 2,2',4,4',5 pentabromodiphenyl ether | 2,2',4,4',5-Pentabromodiphenyl Ether (>80per cent)(Contains ~10per cent 2,2',4,4',5,5'-Hexabromomdip | BDE No 99 | BDE-99 | NCGC00091436-04 | DE 71 | DTXCID404246 | Q412017 | SMR000568490 | N
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Why this grade 50 μg/mL in isooctane for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
DTXSID9030048 | BDE 99 | 2, 2', 4, 4', 5 pentabromodiphenyl ether | 2, 2', 4, 4', 5-Pentabromodiphenyl Ether (>80per cent)(Contains ~10per cent 2, 2', 4, 4', 5, 5'-Hexabromomdip | BDE No 99 | BDE-99 | NCGC00091436-04 | DE 71 | DTXCID404246 | Q412017 | SMR000568490 | N
Specifications & Purity
50 μg/mL in isooctane
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles C1=CC(=C(C=C1Br)Br)OC2=CC(=C(C=C2Br)Br)Br IUPAC Name 1,2,4-tribromo-5-(2,4-dibromophenoxy)benzene InChIKey WHPVYXDFIXRKLN-UHFFFAOYSA-N INCHI 1S/C12H5Br5O/c13-6-1-2-11(9(16)3-6)18-12-5-8(15)7(14)4-10(12)17/h1-5H Isomeric SMILES C1=CC(=C(C=C1Br)Br)OC2=CC(=C(C=C2Br)Br)Br Molecular Weight 564.69 Reaxy-Rn 7538447 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7538447&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Diphenylethers Intermediate Tree Nodes Not available Direct Parent Bromodiphenyl ethers Alternative Parents Diarylethers Phenoxy compounds Phenol ethers Bromobenzenes Aryl bromides Organobromides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Bromodiphenyl ether - Diaryl ether - Phenoxy compound - Phenol ether - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as bromodiphenyl ethers. These are compounds that contain two benzene groups linked to each other via an ether bond, and where at least one ring is substituted with a bromo group. External Descriptors PBDEs Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 564.700 g/mol XLogP3 6.900 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 2 Exact Mass 563.622 Da Monoisotopic Mass 559.626 Da Topological Polar Surface Area 9.200 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 277.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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