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4-Bromo-2-chloro-5-fluoroaniline - 97%, high purity , CAS No.1000572-63-3

COA

Grade & Purity:

≥97%

Cas Number: 1000572-63-3
Molecular Weight: 224.46
PubChem CID: 26599138
PubChem SID: 488200809

In stock

Item Number

B578813

Grouped product items
SKU	Size	Availability	Price
B578813-100mg	100mg	6	$54.90
B578813-250mg	250mg	6	$91.90
B578813-1g	1g	6	$191.90
B578813-5g	5g	5	$711.90

Basic Description

Synonyms	4-Bromo-2-chloro-5-fluoroaniline \| 1000572-63-3 \| CHEMBL4965817 \| SCHEMBL16303511 \| DTXSID40650245 \| MFCD09878155 \| AKOS026671372 \| FS-4351 \| CS-0146362 \| E81876 \| EN300-109514 \| Z1269132427
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged
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 Aniline and substituted anilines

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Aniline and substituted anilines
Intermediate Tree Nodes	Not available
Direct Parent	Aniline and substituted anilines
Alternative Parents	Fluorobenzenes Chlorobenzenes Bromobenzenes Aryl fluorides Aryl chlorides Aryl bromides Primary amines Organofluorides Organochlorides Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aniline or substituted anilines - Bromobenzene - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl fluoride - Aryl halide - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organohalogen compound - Organobromide - Organochloride - Organofluoride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488200809
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488200809
IUPAC Name	4-bromo-2-chloro-5-fluoroaniline
INCHI	InChI=1S/C6H4BrClFN/c7-3-1-4(8)6(10)2-5(3)9/h1-2H,10H2
InChIKey	QIXJYJRZGHXOLM-UHFFFAOYSA-N
Smiles	C1=C(C(=CC(=C1F)Br)Cl)N
Isomeric SMILES	C1=C(C(=CC(=C1F)Br)Cl)N
Molecular Weight	224.46
Reaxy-Rn	34679395
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34679395&ln=

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

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Analytical Chart:

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8 results found

Lot Number	Certificate Type	Date	Item
D2321701	Certificate of Analysis	Mar 20, 2023	B578813
D2321724	Certificate of Analysis	Mar 20, 2023	B578813
D2321731	Certificate of Analysis	Mar 20, 2023	B578813
D2321728	Certificate of Analysis	Mar 20, 2023	B578813
D2321698	Certificate of Analysis	Mar 20, 2023	B578813
D2321702	Certificate of Analysis	Mar 20, 2023	B578813
D2321727	Certificate of Analysis	Mar 20, 2023	B578813
D2321699	Certificate of Analysis	Mar 20, 2023	B578813

Chemical and Physical Properties

Sensitivity	Light sensitive
Molecular Weight	224.460 g/mol
XLogP3	2.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	222.92 Da
Monoisotopic Mass	222.92 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	124.000
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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