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2,6-Difluorobenzophenone - 98%, high purity , CAS No.59189-51-4

COA

Grade & Purity:

≥98%

Cas Number: 59189-51-4
Molecular Weight: 218.2
MDL number: MFCD00009895
PubChem CID: 100979
PubChem SID: 488187227

In stock

Item Number

D111815

Grouped product items
SKU	Size	Availability	Price
D111815-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$26.90
D111815-5g	5g	8	$104.90
D111815-25g	25g	3	$399.90

Basic Description

Synonyms	2,6-Difluorobenzophenone \| 59189-51-4 \| (2,6-Difluorophenyl)(phenyl)methanone \| (2,6-difluorophenyl)-phenylmethanone \| Methanone, (2,6-difluorophenyl)phenyl- \| E47625TKQ5 \| EINECS 261-650-0 \| UNII-E47625TKQ5 \| SCHEMBL1420986 \| DTXSID70207928 \| KTRGJHDNHIPMEY-UHFFFAOYSA-N \| Met
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzophenones

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzophenones
Intermediate Tree Nodes	Not available
Direct Parent	Benzophenones
Alternative Parents	Diphenylmethanes Aryl-phenylketones Benzoyl derivatives Fluorobenzenes Aryl fluorides Vinylogous halides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzophenone - Aryl-phenylketone - Diphenylmethane - Benzoyl - Aryl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Vinylogous halide - Ketone - Organohalogen compound - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
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	488187227
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488187227
IUPAC Name	(2,6-difluorophenyl)-phenylmethanone
INCHI	InChI=1S/C13H8F2O/c14-10-7-4-8-11(15)12(10)13(16)9-5-2-1-3-6-9/h1-8H
InChIKey	KTRGJHDNHIPMEY-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)C(=O)C2=C(C=CC=C2F)F
Isomeric SMILES	C1=CC=C(C=C1)C(=O)C2=C(C=CC=C2F)F
Molecular Weight	218.2
Reaxy-Rn	2266589
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2266589&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
D23131148	Certificate of Analysis	Apr 24, 2023	D111815
D23131140	Certificate of Analysis	Mar 01, 2023	D111815
D2314250	Certificate of Analysis	Mar 01, 2023	D111815
C1505109	Certificate of Analysis	Nov 11, 2022	D111815
C23311538	Certificate of Analysis	Nov 11, 2022	D111815

Chemical and Physical Properties

Refractive Index	1.5645
Boil Point(°C)	120°C
Molecular Weight	218.200 g/mol
XLogP3	3.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	218.054 Da
Monoisotopic Mass	218.054 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	238.000
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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