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3,4-Difluoro-4'-(trans-4-ethylcyclohexyl)biphenyl - ≥98.0%(GC), high purity , CAS No.134412-18-3

COA

Grade & Purity:

≥98%(GC)

Cas Number: 134412-18-3
Molecular Weight: 300.39
MDL number: MFCD12828121
PubChem CID: 612308
PubChem SID: 488190736

In stock

Item Number

D154984

Grouped product items
SKU	Size	Availability	Price
D154984-5g	5g	4	$144.90
D154984-25g	25g	4	$433.90
D154984-100g	100g	2	$1,559.90

View related series

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

Basic Description

Synonyms	AKOS015917722 \| 3,4-Difluoro-4'-(4-ethylcyclohexyl)biphenyl, 97% \| 3,4-difluoro-4'-(4-ethylcyclohexyl)biphenyl \| SCHEMBL12314627 \| 1,1'-Biphenyl, 4'-(4-ethylcyclohexyl)-3,4-difluoro- \| BS-50561 \| FT-0704281 \| SCHEMBL17277229 \| 1903782-77-3 \| 4-[4-(4-ethyl
Specifications & Purity	≥98%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Biphenyls and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Biphenyls and derivatives
Alternative Parents	Fluorobenzenes Aryl fluorides Organofluorides Hydrofluorocarbons Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Biphenyl - 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 biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
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	488190736
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488190736
IUPAC Name	4-[4-(4-ethylcyclohexyl)phenyl]-1,2-difluorobenzene
INCHI	InChI=1S/C20H22F2/c1-2-14-3-5-15(6-4-14)16-7-9-17(10-8-16)18-11-12-19(21)20(22)13-18/h7-15H,2-6H2,1H3
InChIKey	TYZNCUASDJPXMP-UHFFFAOYSA-N
Smiles	CCC1CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)F)F
Isomeric SMILES	CCC1CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)F)F
Molecular Weight	300.39
Reaxy-Rn	11535959
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11535959&ln=

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
B2309642	Certificate of Analysis	Sep 17, 2022	D154984
B2309489	Certificate of Analysis	Sep 17, 2022	D154984
B2309393	Certificate of Analysis	Sep 17, 2022	D154984
B2309530	Certificate of Analysis	Sep 17, 2022	D154984
B2309362	Certificate of Analysis	Sep 17, 2022	D154984
B2309488	Certificate of Analysis	Sep 17, 2022	D154984

Chemical and Physical Properties

Melt Point(°C)	69 °C
Molecular Weight	300.400 g/mol
XLogP3	7.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	300.169 Da
Monoisotopic Mass	300.169 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	327.000
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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