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2',3,4,5-Tetrafluoro-4''-propyl-1,1':4',1''-terphenyl - 98%, high purity , CAS No.205806-87-7

1 Citations

COA

Grade & Purity:

≥98%

Cas Number: 205806-87-7
Molecular Weight: 344.35
MDL number: MFCD12964272
PubChem CID: 12010664
PubChem SID: 488197843

In stock

Item Number

T161965

Grouped product items
SKU	Size	Availability	Price
T161965-200mg	200mg	4	$20.90
T161965-1g	1g	4	$80.90
T161965-5g	5g	3	$240.90
T161965-25g	25g	2	$1,081.90
T161965-100g	100g	1	$3,893.90

View related series

Fluorinated biphenyls and analogues (33) Nematic liquid crystal (96)

Basic Description

Synonyms	1,1':4',1''-Terphenyl,2',3,4,5-tetrafluoro-4''-propyl- \| 2',3,4,5-Tetrafluoro-4''-propyl-1,1':4',1''-terphenyl, >/=98% \| MFCD12964272 \| 1,2,3-trifluoro-5-[2-fluoro-4-(4-propylphenyl)phenyl]benzene \| A855181 \| N10619 \| 1,1':4',1''-Terphenyl, 2',3,4,5-tetra
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Terphenyls
Intermediate Tree Nodes	Not available
Direct Parent	P-terphenyls
Alternative Parents	Biphenyls and derivatives Phenylpropanes Fluorobenzenes Aryl fluorides Organofluorides Hydrofluorocarbons Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Para-terphenyl - Biphenyl - Phenylpropane - 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-terphenyls. These are terphenyls with a structure containing the 1,4-diphenylbenzene skeleton.
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	488197843
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488197843
IUPAC Name	1,2,3-trifluoro-5-[2-fluoro-4-(4-propylphenyl)phenyl]benzene
INCHI	InChI=1S/C21H16F4/c1-2-3-13-4-6-14(7-5-13)15-8-9-17(18(22)10-15)16-11-19(23)21(25)20(24)12-16/h4-12H,2-3H2,1H3
InChIKey	YBPXWWAJMUUUAV-UHFFFAOYSA-N
Smiles	CCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)F)F)F
Isomeric SMILES	CCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)F)F)F
PubChem CID	12010664
Molecular Weight	344.35
Reaxy-Rn	11546625

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

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Analytical Chart:

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9 results found

Lot Number	Certificate Type	Date	Item
B23241130	Certificate of Analysis	Sep 13, 2022	T161965
B23241131	Certificate of Analysis	Sep 13, 2022	T161965
B23241133	Certificate of Analysis	Sep 13, 2022	T161965
B23241138	Certificate of Analysis	Sep 13, 2022	T161965
B23241134	Certificate of Analysis	Sep 13, 2022	T161965
B2324981	Certificate of Analysis	Sep 13, 2022	T161965
B2324976	Certificate of Analysis	Sep 13, 2022	T161965
B2324977	Certificate of Analysis	Sep 13, 2022	T161965
B2324979	Certificate of Analysis	Sep 13, 2022	T161965

Chemical and Physical Properties

Molecular Weight	344.300 g/mol
XLogP3	6.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	344.119 Da
Monoisotopic Mass	344.119 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	395.000
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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