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2′-Fluoro-5′-iodoacetophenone - 97%, high purity , CAS No.1159512-66-9

COA

Grade & Purity:

≥97%

Cas Number: 1159512-66-9
Molecular Weight: 264.03
PubChem CID: 45933739
PubChem SID: 488201259

In stock

Item Number

F336713

Grouped product items
SKU	Size	Availability	Price
F336713-250mg	250mg	4	$66.90
F336713-1g	1g	4	$205.90
F336713-5g	5g	2	$821.90

Basic Description

Synonyms	W16797 \| MFCD12026480 \| PS-7343 \| AKOS026675580 \| DTXSID701298716 \| 1-(2-Fluoro-5-iodophenyl)ethan-1-one \| 2'-Fluoro-5'-iodoacetophenone \| 2-FLUORO-5-IODOACETOPHENONE \| 1159512-66-9 \| SCHEMBL1440124 \| 1-(2-fluoro-5-iodophenyl)ethanone
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Protected from light
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 Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level5 Ketones
        Level6 Aryl ketones
        Level7 Phenylketones
        Level8 Alkyl-phenylketones

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Ketones - Aryl ketones - Phenylketones
Direct Parent	Alkyl-phenylketones
Alternative Parents	Acetophenones Benzoyl derivatives Aryl alkyl ketones Iodobenzenes Fluorobenzenes Aryl iodides Aryl fluorides Vinylogous halides Organoiodides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Alkyl-phenylketone - Acetophenone - Aryl alkyl ketone - Benzoyl - Iodobenzene - Halobenzene - Fluorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Aryl fluoride - Vinylogous halide - Organic oxide - Hydrocarbon derivative - Organoiodide - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl 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	488201259
IUPAC Name	1-(2-fluoro-5-iodophenyl)ethanone
INCHI	InChI=1S/C8H6FIO/c1-5(11)7-4-6(10)2-3-8(7)9/h2-4H,1H3
InChIKey	PAAFYGBEQFBNDA-UHFFFAOYSA-N
Smiles	CC(=O)C1=C(C=CC(=C1)I)F
Isomeric SMILES	CC(=O)C1=C(C=CC(=C1)I)F
Molecular Weight	264.03
Reaxy-Rn	30357642
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=30357642&ln=

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

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Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
C2327432	Certificate of Analysis	Jan 11, 2023	F336713
C2525196	Certificate of Analysis	Jan 11, 2023	F336713
C2327437	Certificate of Analysis	Jan 11, 2023	F336713
C2327440	Certificate of Analysis	Jan 11, 2023	F336713
C2327438	Certificate of Analysis	Jan 11, 2023	F336713
C2327439	Certificate of Analysis	Jan 11, 2023	F336713
C2327443	Certificate of Analysis	Jan 11, 2023	F336713

Chemical and Physical Properties

Sensitivity	light sensitive
Melt Point(°C)	46-46.5 °C
Molecular Weight	264.030 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	263.945 Da
Monoisotopic Mass	263.945 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	160.000
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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