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3-Bromo-2,6-dichloro-4-fluorophenol - 98%, high purity , CAS No.1807542-79-5

COA

Grade & Purity:

≥98%

Cas Number: 1807542-79-5
Molecular Weight: 259.89
PubChem CID: 91844425

In stock

Item Number

B191665

Grouped product items
SKU	Size	Availability	Price	Qty
B191665-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$121.90
B191665-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$362.90

Basic Description

Synonyms	3-Bromo-2,6-dichloro-4-fluorophenol \| 1807542-79-5 \| Phenol, 3-bromo-2,6-dichloro-4-fluoro- \| C6H2BrCl2FO \| DTXSID701282931 \| MFCD28977818 \| AKOS025395553 \| DS-8168 \| CS-0157882 \| C73478
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Halobenzenes
      - Level5 Chlorobenzenes
        Level6 Dichlorobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Chlorobenzenes
Direct Parent	Dichlorobenzenes
Alternative Parents	P-fluorophenols O-chlorophenols M-bromophenols Fluorobenzenes Bromobenzenes Aryl fluorides Aryl chlorides Aryl bromides Organooxygen compounds Organofluorides Organochlorides Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	1,3-dichlorobenzene - 4-halophenol - 3-halophenol - 4-fluorophenol - 2-halophenol - 3-bromophenol - 2-chlorophenol - Bromobenzene - Fluorobenzene - Phenol - Aryl chloride - Aryl bromide - Aryl halide - Aryl fluoride - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organohalogen compound - Organobromide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
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	3-bromo-2,6-dichloro-4-fluorophenol
INCHI	InChI=1S/C6H2BrCl2FO/c7-4-3(10)1-2(8)6(11)5(4)9/h1,11H
InChIKey	PRRQLVPCTWALNT-UHFFFAOYSA-N
Smiles	C1=C(C(=C(C(=C1Cl)O)Cl)Br)F
Isomeric SMILES	C1=C(C(=C(C(=C1Cl)O)Cl)Br)F
PubChem CID	91844425
Molecular Weight	259.89

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	259.880 g/mol
XLogP3	3.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	257.865 Da
Monoisotopic Mass	257.865 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	149.000
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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