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4-(Methoxycarbonyl)furan-2-boronic acid pinacol ester - 98%, high purity , CAS No.1111096-29-7

COA

Grade & Purity:

≥98%

Cas Number: 1111096-29-7
Molecular Weight: 252.07
PubChem CID: 53217215
PubChem SID: 504771101

In stock

Item Number

M586378

Grouped product items
SKU	Size	Availability	Price
M586378-100mg	100mg	2	$40.90
M586378-250mg	250mg	2	$82.90
M586378-1g	1g	1	$216.90

Basic Description

Synonyms	4-(METHOXYCARBONYL)FURAN-2-BORONIC ACID, PINACOL ESTER \| BS-23179 \| EN300-7387929 \| methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-furoate \| RAMMMHGDFUIABW-UHFFFAOYSA-N \| SCHEMBL2723584 \| FT-0700065 \| AKOS015946137 \| MFCD12407248 \| 1111096-29-7
Specifications & Purity	≥98%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Furans
    - Subclass Furoic acid and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Furans
Subclass	Furoic acid and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Furoic acid esters
Alternative Parents	Furan-3-carboxylic acid esters Methyl esters Heteroaromatic compounds Dioxaborolanes Boronic acid esters Oxacyclic compounds Organic metalloid salts Organooxygen compounds Organometalloid compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Furoic acid ester - Furan-3-carboxylic acid ester - Furan-3-carboxylic acid or derivatives - Boronic acid ester - Heteroaromatic compound - 1,3,2-dioxaborolane - Methyl ester - Boronic acid derivative - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Organic metalloid salt - Organic oxygen compound - Hydrocarbon derivative - Organic metalloid moeity - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as furoic acid esters. These are ester derivatives of furoic acid.
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	504771101
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504771101
IUPAC Name	methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-3-carboxylate
INCHI	InChI=1S/C12H17BO5/c1-11(2)12(3,4)18-13(17-11)9-6-8(7-16-9)10(14)15-5/h6-7H,1-5H3
InChIKey	RAMMMHGDFUIABW-UHFFFAOYSA-N
Smiles	B1(OC(C(O1)(C)C)(C)C)C2=CC(=CO2)C(=O)OC
Isomeric SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC(=CO2)C(=O)OC
Molecular Weight	252.07
Reaxy-Rn	22504838
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22504838&ln=

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
J2326711	Certificate of Analysis	Oct 09, 2023	M586378
J2326709	Certificate of Analysis	Oct 09, 2023	M586378
J2326707	Certificate of Analysis	Oct 09, 2023	M586378
J2326706	Certificate of Analysis	Oct 09, 2023	M586378
J2326731	Certificate of Analysis	Oct 09, 2023	M586378
J2326710	Certificate of Analysis	Oct 09, 2023	M586378

Chemical and Physical Properties

Molecular Weight	252.070 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	252.117 Da
Monoisotopic Mass	252.117 Da
Topological Polar Surface Area	57.900 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	325.000
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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