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1-Acetoxy-2-Iodobenzene - 97%, high purity , CAS No.32865-61-5

COA

Grade & Purity:

≥97%

Cas Number: 32865-61-5
Molecular Weight: 262.04
PubChem CID: 141750
PubChem SID: 488188122

In stock

Item Number

I169597

Grouped product items
SKU	Size	Availability	Price
I169597-250mg	250mg	3	$10.90
I169597-1g	1g	3	$36.90
I169597-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$113.90

Basic Description

Synonyms	2-iodophenyl acetate \| 32865-61-5 \| 1-Acetoxy-2-iodobenzene \| (2-iodophenyl) acetate \| Phenol, 2-iodo-, acetate \| 2-iodophenylacetate \| iodophenol acetate \| Phenol,2-iodo-,acetate \| (2-iodanylphenyl) ethanoate \| SCHEMBL177166 \| DTXSID50186520 \| acetic acid (2-iodophenyl) ester
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol esters

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol esters
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol esters
Alternative Parents	Phenoxy compounds Iodobenzenes Aryl iodides Carboxylic acid esters Monocarboxylic acids and derivatives Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenol ester - Phenoxy compound - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoiodide - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
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	488188122
IUPAC Name	(2-iodophenyl) acetate
INCHI	InChI=1S/C8H7IO2/c1-6(10)11-8-5-3-2-4-7(8)9/h2-5H,1H3
InChIKey	SNIVHZRVLQLTLY-UHFFFAOYSA-N
Smiles	CC(=O)OC1=CC=CC=C1I
Isomeric SMILES	CC(=O)OC1=CC=CC=C1I
Molecular Weight	262.04
Reaxy-Rn	1865650
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1865650&ln=

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

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

Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
H2018072	Certificate of Analysis	Jul 09, 2022	I169597
B2217062	Certificate of Analysis	Feb 22, 2022	I169597

Chemical and Physical Properties

Molecular Weight	262.040 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	261.949 Da
Monoisotopic Mass	261.949 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	147.000
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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