Basic Description

Synonyms	4-iodoethylbenzene \| AKOS009157873 \| Iodoethyl benzene \| NCGC00257607-01 \| SCHEMBL172979 \| 2-Iodoethylbenzene \| phenylethyl iodide \| D70924 \| SY050349 \| 2-Phenylethyl iodide \| Benzene, (2-iodoethyl)- \| NCGC00091564-02 \| AS-57952 \| A881743 \| AI3-52406 \| CS
Specifications & Purity	≥98%(GC), stabilized with Copper
Storage Temp	Argon charged
Shipped In	Normal
Product Description	It is a halogenated hydrocarbon. It is reported to undergo triethyl borane-mediated intermolecular radical addition with 2H-azirine-3-carboxylate. (2-Iodoethyl)benzene is suitable for use as starting reagent in the preparation of organic-inorganic hybrid compounds such as, [C6H5CH2NH3]2PbI4, [C6H5CH2CH2SC(NH2 )2]3PbI5 and [C10H7CH2NH3]PbI3.It may be used in the preparation of dioxane-based antiviral agents.

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Associated Targets(Human)

PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)

Discover Target: PPARG

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

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ALOX12 Tchem Arachidonate 12-lipoxygenase (3262 Activities)

Discover Target: ALOX12

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CASP1 Tchem Caspase-1 (6235 Activities)

Discover Target: CASP1

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ALOX15 Tchem Arachidonate 15-lipoxygenase (7108 Activities)

Discover Target: ALOX15

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Lymphoblastoid cell (5959 Activities)

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HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)

Discover Target: HSD17B10

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Associated Targets(non-human)

Cruzipain (33337 Activities)

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Mechanisms of Action

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Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	2-iodoethylbenzene
INCHI	InChI=1S/C8H9I/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChi Key	KVTHPKXDLVYNCH-UHFFFAOYSA-N
Canonical SMILES	C1=CC=C(C=C1)CCI
Isomeric SMILES	C1=CC=C(C=C1)CCI
WGK Germany	3
PubChem CID	28503
Molecular Weight	232.06

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.

14 results found

Lot Number	Certificate Type	Date	Item
D2328190	Certificate of Analysis	Mar 10, 2025	I138375
E2304177	Certificate of Analysis	Feb 07, 2025	I138375
E2304235	Certificate of Analysis	Feb 07, 2025	I138375
D2328184	Certificate of Analysis	Feb 07, 2025	I138375
D2328199	Certificate of Analysis	Feb 07, 2025	I138375
D2328203	Certificate of Analysis	Feb 07, 2025	I138375
C2314306	Certificate of Analysis	Dec 05, 2024	I138375
K2222578	Certificate of Analysis	Sep 06, 2024	I138375
H2409360	Certificate of Analysis	Jun 11, 2024	I138375
B2105473	Certificate of Analysis	Dec 08, 2022	I138375
K2222576	Certificate of Analysis	Oct 29, 2022	I138375
K2222581	Certificate of Analysis	Oct 29, 2022	I138375
K2222582	Certificate of Analysis	Oct 29, 2022	I138375
C2226613	Certificate of Analysis	Jun 01, 2022	I138375

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Chemical and Physical Properties

Solubility	Solubility in water: insoluble in water
Sensitivity	air sensitive;light sensitive
Refractive Index	1.601
Flash Point(°F)	>230 °F
Flash Point(°C)	>110 °C
Boil Point(°C)	122-123 °C/13 mmHg
Molecular Weight	232.060 g/mol
XLogP3	3.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	231.975 Da
Monoisotopic Mass	231.975 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	65.000
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

Safety and Hazards(GHS)

WGK Germany	3

Reviews

References

1. Ha Young Kim, Chinmay Patkar, Ranjit Warrier, Richard Kuhn, Mark Cushman,. (2005-06-02) Design, synthesis, and evaluation of dioxane-based antiviral agents targeted against the Sindbis virus capsid protein.. Bioorganic & medicinal chemistry letters, 15 ((13)): ( 3207-3211 ). [PMID:15927464]

Solution Calculators

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SKU	Size	Availability	Price	Qty
I138375-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$13.90	+-
I138375-5g	5g	5	$53.90	+-
I138375-25g	25g	2	$177.90	+-

(2-Iodoethyl)benzene - ≥98.0%(GC),contains copper as stabilizer, high purity , CAS No.17376-04-4