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(3-Chloro-4-(hydroxymethyl)phenyl)boronic acid（contains varying amounts of Anhydride） - 97%, high purity , CAS No.1190875-60-5

COA

Grade & Purity:

≥97%

Cas Number: 1190875-60-5
Molecular Weight: 186.40
EC Number: ‘824-975-4
PubChem CID: 71433101

In stock

Item Number

C586536

Grouped product items
SKU	Size	Availability	Price
C586536-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$68.90
C586536-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$113.90
C586536-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$279.90

Basic Description

Synonyms	[3-chloro-4-(hydroxymethyl)phenyl]boronic acid \| 3-chloro-4-(hydroxymethyl)phenylboronic acid \| Boronic acid, B-[3-chloro-4-(hydroxymethyl)phenyl]- \| EN300-108852 \| AC7773 \| AKOS027425311 \| 1190875-60-5 \| (3-Chloro-4-(hydroxymethyl)phenyl)boronic acid \| (
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzyl alcohols
Intermediate Tree Nodes	Not available
Direct Parent	Benzyl alcohols
Alternative Parents	Chlorobenzenes Aryl chlorides Boronic acids Organic metalloid salts Primary alcohols Organometalloid compounds Organochlorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzyl alcohol - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Boronic acid derivative - Boronic acid - Organic metalloid salt - Alcohol - Organohalogen compound - Organic metalloid moeity - Organochloride - Organooxygen compound - Primary alcohol - Aromatic alcohol - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzyl alcohols. These are organic compounds containing the phenylmethanol substructure.
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	[3-chloro-4-(hydroxymethyl)phenyl]boronic acid
INCHI	InChI=1S/C7H8BClO3/c9-7-3-6(8(11)12)2-1-5(7)4-10/h1-3,10-12H,4H2
InChIKey	GPDIABAAAASRGZ-UHFFFAOYSA-N
Smiles	B(C1=CC(=C(C=C1)CO)Cl)(O)O
Isomeric SMILES	B(C1=CC(=C(C=C1)CO)Cl)(O)O
Molecular Weight	186.40
Reaxy-Rn	21410006
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21410006&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	186.400 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	186.026 Da
Monoisotopic Mass	186.026 Da
Topological Polar Surface Area	60.700 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	145.000
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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