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4-Bromo-2,3-dimethylphenol - 98%, high purity , CAS No.22802-37-5

COA

Grade & Purity:

≥98%

Cas Number: 22802-37-5
Molecular Weight: 201.1
PubChem CID: 13974656

In stock

Item Number

B182986

Grouped product items
SKU	Size	Availability	Price	Qty
B182986-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$66.90
B182986-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$197.90

Discover 4-Bromo-2,3-dimethylphenol by Aladdin Scientific in 98% for only $66.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-BROMO-2,3-DIMETHYLPHENOL \| 22802-37-5 \| MFCD07778969 \| Phenol,4-bromo-2,3-dimethyl- \| 4-bromo-2,3-dimethyl-phenol \| SCHEMBL1765685 \| DTXSID00553561 \| MOKFDXJOXUHQNO-UHFFFAOYSA-N \| AMY28014 \| XAA80237 \| AKOS024151907 \| SB74530 \| AS-31144 \| SY026366 \| CS-0153607 \| FT-0687040 \| A20624
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenols
    - Subclass Cresols

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	Cresols
Intermediate Tree Nodes	Not available
Direct Parent	Ortho cresols
Alternative Parents	o-Xylenes P-bromophenols Meta cresols Bromobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Organooxygen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	O-xylene - Xylene - 4-bromophenol - O-cresol - M-cresol - 4-halophenol - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Organic oxygen compound - Organohalogen compound - Organobromide - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as ortho cresols. These are organic compounds containing an ortho-cresol moiety, which consists of a benzene bearing one hydroxyl group at ring positions 1 and 2, respectively.
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-2,3-dimethylphenol
INCHI	InChI=1S/C8H9BrO/c1-5-6(2)8(10)4-3-7(5)9/h3-4,10H,1-2H3
InChIKey	MOKFDXJOXUHQNO-UHFFFAOYSA-N
Smiles	CC1=C(C=CC(=C1C)Br)O
Isomeric SMILES	CC1=C(C=CC(=C1C)Br)O
Molecular Weight	201.1
Reaxy-Rn	2554498
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2554498&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	201.060 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	199.984 Da
Monoisotopic Mass	199.984 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	116.000
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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