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4-(Methylsulfonyl)benzyl alcohol - 98%, high purity , CAS No.22821-77-8

COA

Grade & Purity:

≥98%

Cas Number: 22821-77-8
Molecular Weight: 186.2
PubChem CID: 3801026
PubChem SID: 488194575

In stock

Item Number

M182990

Grouped product items
SKU	Size	Availability	Price
M182990-1g	1g	3	$10.90
M182990-5g	5g	3	$26.90
M182990-10g	10g	3	$46.90
M182990-25g	25g	3	$107.90
M182990-100g	100g	3	$388.90

Basic Description

Synonyms	4-(Methylsulfonyl)benzyl Alcohol \| 22821-77-8 \| (4-methylsulfonylphenyl)methanol \| (4-(Methylsulfonyl)phenyl)methanol \| (4-methanesulfonylphenyl)methanol \| P-(METHYLSULFONYL)BENZYL ALCOHOL \| [4-(methylsulfonyl)phenyl]methanol \| MFCD03425695 \| Benzenemethanol, 4-(methylsu
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzenesulfonyl compounds
Intermediate Tree Nodes	Not available
Direct Parent	Benzenesulfonyl compounds
Alternative Parents	Benzyl alcohols Sulfones Primary alcohols Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzenesulfonyl group - Benzyl alcohol - Sulfonyl - Sulfone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organosulfur compound - Organooxygen compound - Alcohol - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl 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	488194575
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488194575
IUPAC Name	(4-methylsulfonylphenyl)methanol
INCHI	InChI=1S/C8H10O3S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
InChIKey	LUECCFBGAJOLOX-UHFFFAOYSA-N
Smiles	CS(=O)(=O)C1=CC=C(C=C1)CO
Isomeric SMILES	CS(=O)(=O)C1=CC=C(C=C1)CO
Molecular Weight	186.2
Reaxy-Rn	2090301
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2090301&ln=

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

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

Analytical Chart:

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10 results found

Lot Number	Certificate Type	Date	Item
H2328547	Certificate of Analysis	Aug 18, 2023	M182990
B2328546	Certificate of Analysis	Aug 18, 2023	M182990
H2328551	Certificate of Analysis	Aug 18, 2023	M182990
H2328549	Certificate of Analysis	Aug 18, 2023	M182990
H2328545	Certificate of Analysis	Aug 18, 2023	M182990
H2328372	Certificate of Analysis	Aug 18, 2023	M182990
H2328371	Certificate of Analysis	Aug 18, 2023	M182990
H2328446	Certificate of Analysis	Aug 18, 2023	M182990
H2328548	Certificate of Analysis	Aug 18, 2023	M182990
H2328550	Certificate of Analysis	Aug 18, 2023	M182990

Chemical and Physical Properties

Sensitivity	Moisture sensitive
Molecular Weight	186.230 g/mol
XLogP3	0.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	186.035 Da
Monoisotopic Mass	186.035 Da
Topological Polar Surface Area	62.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	219.000
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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