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1-[bromo-(4-fluorophenyl)methyl]-4-fluorobenzene - 97%, high purity , CAS No.345-90-4

COA

Grade & Purity:

≥97%

Cas Number: 345-90-4
Molecular Weight: 283.111
PubChem CID: 67665

In stock

Item Number

B192877

Grouped product items
SKU	Size	Availability	Price	Qty
B192877-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$481.90
B192877-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,374.90

Basic Description

Synonyms	345-90-4 \| 1,1'-(Bromomethylene)bis(4-fluorobenzene) \| 4,4'-(BROMOMETHYLENE)BIS(FLUOROBENZENE) \| bromobis(4-fluorophenyl)methane \| 1-[bromo-(4-fluorophenyl)methyl]-4-fluorobenzene \| EINECS 206-465-8 \| bis(4-fluorophenyl)bromomethane \| SCHEMBL4427290 \| bis(4-fluorophenyl)
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Fluorobenzenes Aryl fluorides Organofluorides Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diphenylmethane - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Hydrocarbon derivative - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by 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

IUPAC Name	1-[bromo-(4-fluorophenyl)methyl]-4-fluorobenzene
INCHI	InChI=1S/C13H9BrF2/c14-13(9-1-5-11(15)6-2-9)10-3-7-12(16)8-4-10/h1-8,13H
InChIKey	HXDAZUSPEXGQSS-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1C(C2=CC=C(C=C2)F)Br)F
Isomeric SMILES	C1=CC(=CC=C1C(C2=CC=C(C=C2)F)Br)F
Molecular Weight	283.111
Reaxy-Rn	2052682
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2052682&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	283.110 g/mol
XLogP3	4.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	281.986 Da
Monoisotopic Mass	281.986 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	184.000
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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