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2-Ethoxy-1-naphthaleneboronic acid - 96%, high purity , CAS No.148345-64-6

COA

Grade & Purity:

≥96%

Cas Number: 148345-64-6
Molecular Weight: 216.04
MDL number: MFCD05664211
PubChem CID: 16213801
PubChem SID: 504768241

In stock

Item Number

E120542

Grouped product items
SKU	Size	Availability	Price	Qty
E120542-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$23.90
E120542-5g	5g	1	$92.90

Basic Description

Synonyms	2-Ethoxy-1-naphthaleneboronic acid \| 148345-64-6 \| (2-ethoxynaphthalen-1-yl)boronic acid \| Boronic acid, B-(2-ethoxy-1-naphthalenyl)- \| MFCD05664211 \| 2-Ethoxynaphthalen-1-ylboronic acid \| 2-ETHOXY-1-NAPHTHALENEBORONICACID \| SCHEMBL1642006 \| DTXSID50584123 \| QUDVXFWSKXUSMY
Specifications & Purity	≥96%
Shipped In	Normal
Product Description	Pd-catalyzed Suzuki-Miyaura reaction

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Naphthalenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Naphthalenes
Alternative Parents	Alkyl aryl ethers Boronic acids Organic metalloid salts Organoboron compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Naphthalene - Alkyl aryl ether - Boronic acid - Boronic acid derivative - Organic metalloid salt - Ether - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoboron compound - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
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	504768241
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504768241
IUPAC Name	(2-ethoxynaphthalen-1-yl)boronic acid
INCHI	InChI=1S/C12H13BO3/c1-2-16-11-8-7-9-5-3-4-6-10(9)12(11)13(14)15/h3-8,14-15H,2H2,1H3
InChIKey	QUDVXFWSKXUSMY-UHFFFAOYSA-N
Smiles	B(C1=C(C=CC2=CC=CC=C12)OCC)(O)O
Isomeric SMILES	B(C1=C(C=CC2=CC=CC=C12)OCC)(O)O
WGK Germany	3
Molecular Weight	216.04
Reaxy-Rn	19026841
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19026841&ln=

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

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Analytical Chart:

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Lot Number	Certificate Type	Date	Item
F1804082	Certificate of Analysis	Apr 25, 2022	E120542

Chemical and Physical Properties

Melt Point(°C)	102-106°C
Molecular Weight	216.040 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	216.096 Da
Monoisotopic Mass	216.096 Da
Topological Polar Surface Area	49.700 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	222.000
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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