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2,6-Difluoro-3-methylbenzyl bromide - 95%, high purity , CAS No.261763-44-4

COA

Grade & Purity:

≥95%

Cas Number: 261763-44-4
Molecular Weight: 221.05
MDL number: MFCD01631336
PubChem CID: 2774150
PubChem SID: 504761873

In stock

Item Number

D300663

Grouped product items
SKU	Size	Availability	Price
D300663-250mg	250mg	3	$11.90
D300663-1g	1g	3	$36.90
D300663-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$153.90

Basic Description

Synonyms	2,6-Difluoro-3-methylbenzyl bromide \| 261763-44-4 \| 2-(bromomethyl)-1,3-difluoro-4-methylbenzene \| Benzene, 2-(bromomethyl)-1,3-difluoro-4-methyl- \| 2-Bromomethyl-1,3-difluoro-4-methyl-benzene \| SCHEMBL378747 \| DTXSID00378913 \| MFCD01631336 \| AKOS015854288 \| PS-10013 \| FT-06
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzyl halides
Intermediate Tree Nodes	Not available
Direct Parent	Benzyl bromides
Alternative Parents	Toluenes Fluorobenzenes Aryl fluorides Organofluorides Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzyl bromide - Toluene - 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 benzyl bromides. These are organic compounds containing a benzene skeleton substituted with a bromomethyl 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	504761873
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761873
IUPAC Name	2-(bromomethyl)-1,3-difluoro-4-methylbenzene
INCHI	InChI=1S/C8H7BrF2/c1-5-2-3-7(10)6(4-9)8(5)11/h2-3H,4H2,1H3
InChIKey	IHFNXAURNLUMOH-UHFFFAOYSA-N
Smiles	CC1=C(C(=C(C=C1)F)CBr)F
Isomeric SMILES	CC1=C(C(=C(C=C1)F)CBr)F
Molecular Weight	221.05
Reaxy-Rn	10153363
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10153363&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
G2131364	Certificate of Analysis	May 17, 2024	D300663
D2303853	Certificate of Analysis	Feb 02, 2023	D300663
D2303844	Certificate of Analysis	Feb 02, 2023	D300663
D2303810	Certificate of Analysis	Feb 02, 2023	D300663

Chemical and Physical Properties

Boil Point(°C)	76°C/3mm
Molecular Weight	221.040 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	219.97 Da
Monoisotopic Mass	219.97 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	129.000
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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