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3-Bromo-4,5-difluoroaniline - 98%, high purity , CAS No.875664-41-8

COA

Grade & Purity:

≥98%

Cas Number: 875664-41-8
Molecular Weight: 208.01
MDL number: MFCD08062370
PubChem CID: 42552913
PubChem SID: 488200892

In stock

Item Number

B122510

Grouped product items
SKU	Size	Availability	Price
B122510-250mg	250mg	4	$343.90
B122510-1g	1g	4	$1,030.90
B122510-5g	5g	2	$3,084.90

Basic Description

Synonyms	3-Bromo-4,5-difluoroaniline \| 875664-41-8 \| MFCD08062370 \| 3-Bromo-4,5-difluoro aniline \| SCHEMBL15573666 \| DTXSID30654737 \| GYPOUGZGHDSUKH-UHFFFAOYSA-N \| 3-Bromo-4,5-difluoro-phenylamine \| BBL101274 \| STL555070 \| Benzenamine, 3-bromo-4,5-difluoro- \| AKOS005257945 \| AC-3712 \| AM62
Specifications & Purity	≥98%
Shipped In	Normal

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 Bromobenzenes Aryl fluorides Aryl bromides Primary amines Organofluorides Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aniline or substituted anilines - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Amine - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - 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

Names and Identifiers

Pubchem Sid	488200892
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488200892
IUPAC Name	3-bromo-4,5-difluoroaniline
INCHI	InChI=1S/C6H4BrF2N/c7-4-1-3(10)2-5(8)6(4)9/h1-2H,10H2
InChIKey	GYPOUGZGHDSUKH-UHFFFAOYSA-N
Smiles	C1=C(C=C(C(=C1F)F)Br)N
Isomeric SMILES	C1=C(C=C(C(=C1F)F)Br)N
Molecular Weight	208.01
Reaxy-Rn	26678271
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=26678271&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot Number	Certificate Type	Date	Item
C2314525	Certificate of Analysis	Apr 08, 2023	B122510
C2314520	Certificate of Analysis	Mar 29, 2023	B122510
A1522063	Certificate of Analysis	Sep 19, 2022	B122510
C1819083	Certificate of Analysis	Jan 20, 2022	B122510

Chemical and Physical Properties

Sensitivity	Moisture Sensitive
Melt Point(°C)	66-69°C
Molecular Weight	208.000 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	206.95 Da
Monoisotopic Mass	206.95 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	122.000
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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