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B-(4-Bromo-2,5-dimethoxyphenyl)boronic acid (contains varying amounts of Anhydride) - 95%, high purity , CAS No.950846-26-1

COA

Grade & Purity:

≥95%

Cas Number: 950846-26-1
Molecular Weight: 260.88
PubChem CID: 23005404

In stock

Item Number

B196036

Grouped product items
SKU	Size	Availability	Price
B196036-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
B196036-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$32.90
B196036-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$102.90
B196036-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$360.90

Basic Description

Synonyms	950846-26-1 \| (4-bromo-2,5-dimethoxyphenyl)boronic acid \| 4-BROMO-2,5-DIMETHOXYPHENYLBORONIC ACID \| MFCD07778019 \| B-(4-Bromo-2,5-dimethoxyphenyl)boronic acid \| (4-BROMO-2,5-DIMETHOXYPHENYL)BORONICACID \| SCHEMBL12811484 \| DTXSID80629652 \| AMY22089 \| AKOS004114049 \| DS-16547 \|
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Methoxybenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Dimethoxybenzenes
Alternative Parents	Phenoxy compounds Anisoles Bromobenzenes Alkyl aryl ethers Aryl bromides Boronic acids Organic metalloid salts Organometalloid compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Boronic acid derivative - Boronic acid - Organic metalloid salt - Ether - Organic metalloid moeity - Organobromide - Organooxygen compound - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
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	(4-bromo-2,5-dimethoxyphenyl)boronic acid
INCHI	InChI=1S/C8H10BBrO4/c1-13-7-4-6(10)8(14-2)3-5(7)9(11)12/h3-4,11-12H,1-2H3
InChIKey	VFSKPPVNGHKIFE-UHFFFAOYSA-N
Smiles	B(C1=CC(=C(C=C1OC)Br)OC)(O)O
Isomeric SMILES	B(C1=CC(=C(C=C1OC)Br)OC)(O)O
Molecular Weight	260.88
Reaxy-Rn	11215016
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11215016&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	260.880 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	259.986 Da
Monoisotopic Mass	259.986 Da
Topological Polar Surface Area	58.900 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	181.000
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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