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Dechlorane A - Reagent grade, high purity , CAS No.13560-89-9

COA

Grade & Purity:

Reagent Grade

Cas Number: 13560-89-9
Molecular Weight: 653.72
Beilstein Registry Number: 2195908
EC Number: 236-948-9
PubChem CID: 26111
PubChem SID: 504753328

In stock

Item Number

D342339

Grouped product items
SKU	Size	Availability	Price
D342339-10mg	10mg	5	$266.90
D342339-25mg	25mg	1	$712.90
D342339-50mg	50mg	1	$1,187.90
D342339-100mg	100mg	1	$2,137.90

an organochlorine pollutant

Basic Description

Synonyms	4-05-00-01783 (Beilstein Handbook Reference) \| Dodecachlorododecahydrodimethanodibenzocyclooctane \| DTXSID7027750 \| 1,4:7,10-Dimethanodibenzo(a,e)cyclooctene, 1,2,3,4,7,8,9,10,13,13,14,14-dodecachloro-1,4,4a,5,6,6a,7,10,10a,11,12,12a-dodecahydro- \| 1,6,7,
Specifications & Purity	Reagent grade
Storage Temp	Protected from light,Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Grade	Reagent Grade
Product Description	Applications： A chlorinated polycyclic compound as flame retardant and organochlorine pollutant.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Vinyl halides
    - Subclass Vinyl chlorides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Vinyl halides
Subclass	Vinyl chlorides
Intermediate Tree Nodes	Not available
Direct Parent	Vinyl chlorides
Alternative Parents	Chloroalkenes Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Chloroalkene - Haloalkene - Vinyl chloride - Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as vinyl chlorides. These are vinyl halides in which a chlorine atom is bonded to an sp2-hybridised carbon atom.
External Descriptors	Not available
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504753328
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504753328
IUPAC Name	1,6,7,8,9,14,15,16,17,17,18,18-dodecachloropentacyclo[12.2.1.16,9.02,13.05,10]octadeca-7,15-diene
INCHI	InChI=1S/C18H12Cl12/c19-9-10(20)15(25)7-3-4-8-6(2-1-5(7)13(9,23)17(15,27)28)14(24)11(21)12(22)16(8,26)18(14,29)30/h5-8H,1-4H2
InChIKey	UGQQAJOWXNCOPY-UHFFFAOYSA-N
Smiles	C1CC2C(CCC3C1C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl)C5(C(=C(C2(C5(Cl)Cl)Cl)Cl)Cl)Cl
Isomeric SMILES	C1CC2C(CCC3C1C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl)C5(C(=C(C2(C5(Cl)Cl)Cl)Cl)Cl)Cl
RTECS	IO1430000
UN Number	2811
Packing Group	III
Molecular Weight	653.72
Beilstein	2195908
Reaxy-Rn	2195908
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2195908&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
F2307201	Certificate of Analysis	Jun 01, 2023	D342339
F2307206	Certificate of Analysis	Jun 01, 2023	D342339
F2307207	Certificate of Analysis	Jun 01, 2023	D342339
F2307203	Certificate of Analysis	Jun 01, 2023	D342339
F2307244	Certificate of Analysis	Jun 01, 2023	D342339
F2307243	Certificate of Analysis	Jun 01, 2023	D342339
F2307200	Certificate of Analysis	Jun 01, 2023	D342339
F2307202	Certificate of Analysis	Jun 01, 2023	D342339

Chemical and Physical Properties

Solubility	Soluble in chloroform, o-dichlorobenzene, benzene (2.0 g/100g), xylene (1.0 g/100g), styrene (1.8 g/100g), trichloroethylene (1.4 g/100g), methylethylketone (0.7 g/100g), n-butyl acetate (0.7 g/100g), hexane (0.1 g/100g), and methyl alcohol (0.1 g/100g).
Sensitivity	Light sensitive；Moisture sensitive
Boil Point(°C)	~599.84° C at 760 mmHg (Predicted)
Melt Point(°C)	>300° C
Molecular Weight	653.700 g/mol
XLogP3	8.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	653.711 Da
Monoisotopic Mass	647.72 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	782.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	8
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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