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PSS-Chloropropyl-Heptaisobutyl substituted - 97%, high purity , CAS No.480438-84-4

COA

Grade & Purity:

≥97%

Cas Number: 480438-84-4
Molecular Weight: 894.01
MDL number: MFCD03427223
PubChem CID: 4109018

In stock

Item Number

P469258

Grouped product items
SKU	Size	Availability	Price
P469258-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$45.90
P469258-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$126.90
P469258-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$439.90

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Organosilicon Reagents (24)

Basic Description

Synonyms	DTXSID90399410 \| 1-(3-Chloropropyl)-3,5,7,9,11,13,15-heptakis(2-methylpropyl)pentacyclo[9.5.1.1~3,9~.1~5,15~.1~7,13~]octasiloxane \| 1-(3-Chloropropyl)-3,5,7,9,11,13,15-heptaisobutyl-2,4,6,8,10,12,14,16,17,18,19,20-dodecaoxa-1,3,5,7,9,11,13,15-octasilapent
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organometallic compounds
  - Class Organometalloid compounds
    - Subclass Organosilicon compounds

Kingdom	Organic compounds
Superclass	Organometallic compounds
Class	Organometalloid compounds
Subclass	Organosilicon compounds
Intermediate Tree Nodes	Not available
Direct Parent	Organoheterosilanes
Alternative Parents	Oxacyclic compounds Organic metalloid salts Organochlorides Organic oxygen compounds Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Organoheterosilane - Oxacycle - Organic metalloid salt - Organic oxygen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as organoheterosilanes. These are organosilicon compounds where the tetravalent silicon atom is linked to one or more heteroatoms.
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

IUPAC Name	1-(3-chloropropyl)-3,5,7,9,11,13,15-heptakis(2-methylpropyl)-2,4,6,8,10,12,14,16,17,18,19,20-dodecaoxa-1,3,5,7,9,11,13,15-octasilapentacyclo[9.5.1.13,9.15,15.17,13]icosane
INCHI	InChI=1S/C31H69ClO12Si8/c1-25(2)18-46-33-45(17-15-16-32)34-47(19-26(3)4)38-49(36-46,21-28(7)8)42-52(24-31(13)14)43-50(37-46,22-29(9)10)39-48(35-45,20-27(5)6)41-51(40-47,44-52)23-30(11)12/h25-31H,15-24H2,1-14H3
InChIKey	XVYCGZTZIHTXDL-UHFFFAOYSA-N
Smiles	CC(C)C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CCCCl
Isomeric SMILES	CC(C)C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CCCCl
PubChem CID	4109018
Molecular Weight	894.01

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.

5 results found

Lot Number	Certificate Type	Date	Item
E2507549	Certificate of Analysis	Apr 24, 2025	P469258
E2507539	Certificate of Analysis	Apr 24, 2025	P469258
E2507540	Certificate of Analysis	Apr 24, 2025	P469258
E2507541	Certificate of Analysis	Apr 24, 2025	P469258
E2507542	Certificate of Analysis	Apr 24, 2025	P469258

Chemical and Physical Properties

Solubility	THF: soluble; acetonitrile: insoluble; chloroform: soluble; methanol: insoluble
Flash Point(°F)	Not applicable
Flash Point(°C)	Not applicable
Melt Point(°C)	214-219℃ (lit.)
Molecular Weight	894.000 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	17
Exact Mass	892.263 Da
Monoisotopic Mass	892.263 Da
Topological Polar Surface Area	111.000 Å²
Heavy Atom Count	52
Formal Charge	0
Complexity	1080.000
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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