Skip to the beginning of the images gallery

3,4-Difluorobenzophenone - 98%, high purity , CAS No.85118-07-6

COA

Grade & Purity:

≥98%

Cas Number: 85118-07-6
Molecular Weight: 218.2
EC Number: 285-659-4
MDL number: MFCD00009892
PubChem CID: 569908
PubChem SID: 488190354

In stock

Item Number

D111816

Grouped product items
SKU	Size	Availability	Price
D111816-1g	1g	3	$16.90
D111816-5g	5g	9	$64.90
D111816-25g	25g	8	$290.90
D111816-100g	100g	2	$1,046.90

View related series

Carbonyl compound (2335) Non heterocyclic fluorine-containing block (1408)

Basic Description

Synonyms	D3576 \| EINECS 285-659-4 \| N11928 \| (3,4-Difluorophenyl)(phenyl)methanone \| FT-0614281 \| Amino-(tetrahydropyran-4-yl)aceticacidmethylester \| (3,4-Difluorophenyl)(phenyl)methanone # \| J-501095 \| 3,4-Difluorobenzophenone \| AM62121 \| SCHEMBL332679 \| 3,4-Difl
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 Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzophenone - Diphenylmethane - Aryl-phenylketone - Benzoyl - Aryl ketone - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Ketone - Organooxygen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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	488190354
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488190354
IUPAC Name	(3,4-difluorophenyl)-phenylmethanone
INCHI	InChI=1S/C13H8F2O/c14-11-7-6-10(8-12(11)15)13(16)9-4-2-1-3-5-9/h1-8H
InChIKey	ZJTYHSBOZAQQGF-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)F)F
Isomeric SMILES	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)F)F
WGK Germany	3
Molecular Weight	218.2
Reaxy-Rn	7808356
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7808356&ln=

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.

9 results found

Lot Number	Certificate Type	Date	Item
K2224376	Certificate of Analysis	Nov 11, 2022	D111816
K2224394	Certificate of Analysis	Nov 11, 2022	D111816
K2224369	Certificate of Analysis	Nov 11, 2022	D111816
C23311533	Certificate of Analysis	Nov 11, 2022	D111816
K2224395	Certificate of Analysis	Nov 11, 2022	D111816
C23311532	Certificate of Analysis	Nov 11, 2022	D111816
K2224393	Certificate of Analysis	Nov 11, 2022	D111816
J2222038	Certificate of Analysis	Nov 04, 2022	D111816
K1411016	Certificate of Analysis	Aug 08, 2022	D111816

Chemical and Physical Properties

Flash Point(°F)	>110℃
Flash Point(°C)	>110℃
Melt Point(°C)	55-57°C
Molecular Weight	218.200 g/mol
XLogP3	3.700
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	248.000
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

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration