2-Iodobenzonitrile - 97%, high purity , CAS No.4387-36-4

Item Number

I130037

Grouped product items
SKU	Size	Availability	Price	Qty
I130037-1g	1g	3	$25.90	+-
I130037-5g	5g	2	$115.90	+-
I130037-10g	10g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$207.90	+-
I130037-25g	25g	3	$211.90	+-
I130037-100g	100g	1	$762.90	+-

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Basic Description

Synonyms	A7018 \| PS-7743 \| 2-cyanoiodobenzene \| MFCD00079761 \| DTXSID40374757 \| 2-Cyanophenyl iodide \| EN300-59601 \| CS-W010392 \| AM20040480 \| FT-0612668 \| Benzonitrile, 2-iodo- \| 2-Iodobenzonitrile \| AC-1185 \| 2-Iodophenyl cyanide \| SCHEMBL365279 \| AE-641/0325501
Specifications & Purity	≥97%
Storage Temp	Protected from light
Shipped In	Normal

Names and Identifiers

Pubchem Sid	504761554
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761554
IUPAC Name	2-iodobenzonitrile
INCHI	InChI=1S/C7H4IN/c8-7-4-2-1-3-6(7)5-9/h1-4H
InChi Key	JDDAFHUEOVUDFJ-UHFFFAOYSA-N
Canonical SMILES	C1=CC=C(C(=C1)C#N)I
Isomeric SMILES	C1=CC=C(C(=C1)C#N)I
WGK Germany	3
PubChem CID	2759358
Molecular Weight	229.02
Beilstein	9(3)1436
Reaxy-Rn	1859738

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

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

Analytical Chart:

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9 results found

Lot Number	Certificate Type	Date	Item
A1916069	Certificate of Analysis	Jun 14, 2024	I130037
C1414044	Certificate of Analysis	Oct 07, 2023	I130037
L2104068	Certificate of Analysis	Sep 19, 2023	I130037
L2104069	Certificate of Analysis	Sep 19, 2023	I130037
L2104070	Certificate of Analysis	Sep 19, 2023	I130037
H2323069	Certificate of Analysis	Aug 30, 2023	I130037
H2323072	Certificate of Analysis	Aug 28, 2023	I130037
D2315387	Certificate of Analysis	Dec 10, 2021	I130037
D2315401	Certificate of Analysis	Dec 10, 2021	I130037

Chemical and Physical Properties

Solubility	Soluble in Methanol
Flash Point(°F)	>230 °F
Flash Point(°C)	110°C
Boil Point(°C)	147°C/15mmHg
Melt Point(°C)	53.0-57.0°C
Molecular Weight	229.020 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	228.939 Da
Monoisotopic Mass	228.939 Da
Topological Polar Surface Area	23.800 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	135.000
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)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H319:Causes serious eye irritation H335:May cause respiratory irritation H302:Harmful if swallowed
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P330:Rinse mouth. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P317:IF SWALLOWED: Get medical help. P337+P317:If eye irritation persists: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Reaxy-Rn	1859738

References

1. Felix Bacher, Christopher Wittmann, Márta Nové, Gabriella Spengler, Małgorzata A Marć, Eva A Enyedy, Denisa Darvasiová, Peter Rapta, Thomas Reiner, Vladimir B Arion,. (2019-05-28) Novel latonduine derived proligands and their copper(ii) complexes show cytotoxicity in the nanomolar range in human colon adenocarcinoma cells and in vitro cancer selectivity.. Dalton transactions (Cambridge, England : 2003), 48 ((28)): ( 10464-10478 ). [PMID:31125040]

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Basic Description