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2,6-Dibromo-4-methylaniline - >98.0%(GC), high purity , CAS No.6968-24-7

COA

Grade & Purity:

≥98%(GC)

Cas Number: 6968-24-7
Molecular Weight: 264.95
Beilstein Registry Number: 12(4)1996
MDL number: MFCD00007641
PubChem CID: 81427
PubChem SID: 488185964

In stock

Item Number

D154485

Grouped product items
SKU	Size	Availability	Price
D154485-5g	5g	Available within 1-2 weeks(?) Item is derived from our semi-finished stock and is processed in 1-2 weeks.	$18.90
D154485-25g	25g	7	$81.90
D154485-100g	100g	5	$292.90
D154485-500g	500g	2	$1,315.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	NSC20674 \| NSC-20674 \| 3-Acetylpyridine NAD \| AKOS000119147 \| EINECS 230-182-9 \| 2,6-Dibromo-p-toluidine \| D3577 \| BBL020090 \| AM20041029 \| 2,6-dibromo-4-methylphenylamine \| InChI=1/C7H7Br2N/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,10H2,1H \| MFCD00007641 \| 2,6-Dibro
Specifications & Purity	≥98%(GC)
Storage Temp	Argon charged
Shipped In	Normal
Product Description	application： 2,6-Dibromo-4-methylaniline is used as coupling reagent in spectrophotometric determination of carbaryl in various environmental samples. It was also in preparation of 2-bromo-6-iodo-4-methylaniline. 2,6-Dibromo-4-methylaniline undergoes Suzuki-coupling reaction with 2-dihydroxyboryl-3-methyl-2-cyclopenten-1-one during synthesis of the dinuclear dichlorotitanium complexes. 2,6-Dibromo-4-methylaniline is also used as an intermediate for the synthesis of pharmaceutucals, agrochemicals, dyes and other organic chemicals.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Toluenes
Intermediate Tree Nodes	Not available
Direct Parent	Aminotoluenes
Alternative Parents	2-bromoanilines Bromobenzenes Aryl bromides Primary amines Organopnictogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	2-bromoaniline - Aniline or substituted anilines - Aminotoluene - Bromobenzene - Halobenzene - Aryl halide - Aryl bromide - Organic nitrogen compound - Primary amine - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.
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	488185964
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488185964
IUPAC Name	2,6-dibromo-4-methylaniline
INCHI	InChI=1S/C7H7Br2N/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,10H2,1H3
InChIKey	ATDIROHVRVQMRO-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C(=C1)Br)N)Br
Isomeric SMILES	CC1=CC(=C(C(=C1)Br)N)Br
WGK Germany	3
Molecular Weight	264.95
Beilstein	12(4)1996
Reaxy-Rn	2085782
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2085782&ln=

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

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

Analytical Chart:

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11 results found

Lot Number	Certificate Type	Date	Item
F2313879	Certificate of Analysis	Jun 25, 2023	D154485
F2313888	Certificate of Analysis	Jun 25, 2023	D154485
F2313887	Certificate of Analysis	Jun 25, 2023	D154485
F2313912	Certificate of Analysis	Jun 25, 2023	D154485
F2313884	Certificate of Analysis	Jun 25, 2023	D154485
D23061209	Certificate of Analysis	Jun 17, 2022	D154485
D23061210	Certificate of Analysis	Jun 17, 2022	D154485
B2212322	Certificate of Analysis	Jun 17, 2022	D154485
B2212324	Certificate of Analysis	Jun 17, 2022	D154485
B2212325	Certificate of Analysis	Jun 17, 2022	D154485
B2212326	Certificate of Analysis	Jun 17, 2022	D154485

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Chemical and Physical Properties

Solubility	Insoluble in water.
Sensitivity	air sensitive
Melt Point(°C)	72-76°C
Molecular Weight	264.940 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	264.892 Da
Monoisotopic Mass	262.895 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	106.000
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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