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1-Iodooctane (stabilized with Copper chip) - >97.0%(GC), high purity , CAS No.629-27-6

1 Citations

COA

Grade & Purity:

≥97%(GC)

Cas Number: 629-27-6
Molecular Weight: 240.13
Beilstein Registry Number: 1697480
MDL number: MFCD00001105
PubChem CID: 12380
PubChem SID: 488181644

In stock

Item Number

I157580

Grouped product items
SKU	Size	Availability	Price
I157580-5g	5g	5	$9.90
I157580-25g	25g	3	$24.90
I157580-100g	100g	2	$64.90
I157580-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$290.90

View related series

Haloalkane (186) Non heterocyclic block (8163)

Basic Description

Synonyms	AKOS009031583 \| 1-iodoctane \| POTASSIUM(4-METHOXYCARBONYLPHENYL)TRIFLUOROBORATE \| 1-Iodooctane, purum, >=97.0% (GC) \| 1-n-Octyl iodide \| EINECS 211-084-5 \| J-802038 \| BRN 1697479 \| SCHEMBL84103 \| A834094 \| n-octyliodide \| Octane, 1-iodo- \| BBL027322 \| J-8
Specifications & Purity	≥97%(GC)
Shipped In	Normal
Product Description	It undergoes catalytic reduction by nickel (I) salen electrogenerated at a glassy carbon cathode in dimethylformamide. Radical mechanism of formation of monolayer on silicon ground in the presence of 1-iodooctane has been studied by X-ray photoelectron spectroscopy. Alkylation of [2,2-([2,2-bipyridine]-6,6-diyl)bis[phenolato]-N,N,O,O]nickel(II)was performed using the catalytic reduction of 1-iodooctane. Primary alkyl iodide 1-iodooctane reacts with lithium aluminum deuteride (LAD) in a 1:0.2 ratio to form 1-deuteriooctane.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Organoiodides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Organoiodides
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organoiodides
Alternative Parents	Hydrocarbon derivatives Alkyl iodides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Hydrocarbon derivative - Organoiodide - Alkyl iodide - Alkyl halide - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organoiodides. These are compounds containing a chemical bond between a carbon atom and an iodine 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	488181644
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181644
IUPAC Name	1-iodooctane
INCHI	InChI=1S/C8H17I/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
InChIKey	UWLHSHAHTBJTBA-UHFFFAOYSA-N
Smiles	CCCCCCCCI
Isomeric SMILES	CCCCCCCCI
WGK Germany	3
RTECS	RG9700100
Molecular Weight	240.13
Beilstein	1697480
Reaxy-Rn	1697479
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697479&ln=

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

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

Analytical Chart:

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11 results found

Lot Number	Certificate Type	Date	Item
K2406448	Certificate of Analysis	Jul 04, 2024	I157580
K2406451	Certificate of Analysis	Jul 04, 2024	I157580
K2406452	Certificate of Analysis	Jul 04, 2024	I157580
K2215069	Certificate of Analysis	Nov 19, 2022	I157580
C2508061	Certificate of Analysis	Oct 14, 2022	I157580
J2228663	Certificate of Analysis	Oct 14, 2022	I157580
J2228665	Certificate of Analysis	Oct 14, 2022	I157580
J2228693	Certificate of Analysis	Oct 14, 2022	I157580
J2228683	Certificate of Analysis	Oct 14, 2022	I157580
D2320056	Certificate of Analysis	Oct 14, 2022	I157580
D1819099	Certificate of Analysis	Feb 14, 2022	I157580

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Chemical and Physical Properties

Solubility	Insoluble in water.
Sensitivity	light sensitive
Refractive Index	1.4878
Flash Point(°F)	203°F
Flash Point(°C)	95 °C
Boil Point(°C)	225-226 °C
Melt Point(°C)	-46~-45 °C
Molecular Weight	240.120 g/mol
XLogP3	5.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	6
Exact Mass	240.037 Da
Monoisotopic Mass	240.037 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	43.800
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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