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4,4,5,5-Tetramethyl-2-(oxetan-3-yl)-1,3,2-dioxaborolane - 97%, high purity , CAS No.1396215-84-1

COA

Grade & Purity:

≥97%

Cas Number: 1396215-84-1
Molecular Weight: 184.04
EC Number: 810-856-4
PubChem CID: 84223807

In stock

Item Number

T587144

Grouped product items
SKU	Size	Availability	Price	Qty
T587144-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$236.90
T587144-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$498.90

Basic Description

Synonyms	FT-0774748 \| Oxetane-3-boronic acid pinacol ester \| 1396215-84-1 \| EN300-214041 \| C9H17BO3 \| A885968 \| 4,4,5,5-Teteamethyl-2-(oxetan-3-yl)-1,3,2-dioxaborolane \| AKOS016339172 \| AMY1190 \| MFCD26521383 \| OXETAN-3-YLBORONIC ACID PINACOL ESTER \| GS-2519 \| 1,3
Specifications & Purity	≥97%
Storage Temp	Store at -20°C,Desiccated
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 Organic acids and derivatives
  - Class Boronic acid derivatives
    - Subclass Boronic acid esters

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Boronic acid derivatives
Subclass	Boronic acid esters
Intermediate Tree Nodes	Not available
Direct Parent	Boronic acid esters
Alternative Parents	Dioxaborolanes Oxetanes Oxacyclic compounds Organic metalloid salts Dialkyl ethers Monoalkylboranes Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	1,3,2-dioxaborolane - Boronic acid ester - Oxetane - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Ether - Dialkyl ether - Organic oxygen compound - Monoalkylborane - Alkylborane - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoboron compound - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as boronic acid esters. These are compounds comprising the boronic acid ester functional group RN(X)OR' (R,R'=alkyl, aryl; X= any O, N, Hal residue).
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	4,4,5,5-tetramethyl-2-(oxetan-3-yl)-1,3,2-dioxaborolane
INCHI	InChI=1S/C9H17BO3/c1-8(2)9(3,4)13-10(12-8)7-5-11-6-7/h7H,5-6H2,1-4H3
InChIKey	LBABXQQSDMILIX-UHFFFAOYSA-N
Smiles	B1(OC(C(O1)(C)C)(C)C)C2COC2
Isomeric SMILES	B1(OC(C(O1)(C)C)(C)C)C2COC2
Alternate CAS	1396215-84-1
PubChem CID	84223807
Molecular Weight	184.04

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	184.040 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	184.127 Da
Monoisotopic Mass	184.127 Da
Topological Polar Surface Area	27.700 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	195.000
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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