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2,3,5,6-Tetrafluoro-p-xylene - 97%, high purity , CAS No.703-87-7

COA

Grade & Purity:

≥97%

Cas Number: 703-87-7
Molecular Weight: 178.13
MDL number: MFCD00012231
PubChem CID: 136549

In stock

Item Number

T161910

Grouped product items
SKU	Size	Availability	Price
T161910-200mg	200mg	1	$16.90
T161910-1g	1g	2	$61.90
T161910-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$160.90

View related series

Non heterocyclic fluorine-containing block (1408) Synthetic block (741)

Basic Description

Synonyms	Benzene,1,2,4,5-tetrafluoro-3,6-dimethyl- \| DTXSID30220572 \| 1,4-Dimethyltetrafluorobenzene \| MFCD00012231 \| SCHEMBL926802 \| FT-0632850 \| T1947 \| 2,3,5,6-Tetrafluoro-p-xylene \| AM20041048 \| tetrafluoro-p-xylene \| T72855 \| 1,2,4,5-tetrakis(fluoranyl)-3,6-d
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
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 Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Xylenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Xylenes
Intermediate Tree Nodes	Not available
Direct Parent	p-Xylenes
Alternative Parents	Fluorobenzenes Aryl fluorides Organofluorides Hydrofluorocarbons Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	P-xylene - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Hydrofluorocarbon - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as p-xylenes. These are aromatic compounds that contain a p-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 4-positions.
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

IUPAC Name	1,2,4,5-tetrafluoro-3,6-dimethylbenzene
INCHI	InChI=1S/C8H6F4/c1-3-5(9)7(11)4(2)8(12)6(3)10/h1-2H3
InChIKey	IWKPBYPUIPVYNZ-UHFFFAOYSA-N
Smiles	CC1=C(C(=C(C(=C1F)F)C)F)F
Isomeric SMILES	CC1=C(C(=C(C(=C1F)F)C)F)F
PubChem CID	136549
Molecular Weight	178.13
Reaxy-Rn	2329684

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.

3 results found

Lot Number	Certificate Type	Date	Item
C2310438	Certificate of Analysis	Dec 16, 2022	T161910
C2310575	Certificate of Analysis	Dec 16, 2022	T161910
C2310478	Certificate of Analysis	Dec 16, 2022	T161910

Chemical and Physical Properties

Solubility	Slightly soluble in Methanol
Melt Point(°C)	35 °C
Molecular Weight	178.130 g/mol
XLogP3	3.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	178.041 Da
Monoisotopic Mass	178.041 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	127.000
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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