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Carbonicacid, 1,1-dimethylethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylester

Carbonicacid, 1,1-dimethylethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylester

Name: Carbonicacid, 1,1-dimethylethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylester
Brand: BOC Sciences
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Molecular Formula:

C17H25 B O5

Molecular Weight:

320.19

CAS Number:

480438-75-3

Catalog Number:

480438-75-3

Product Information

Molecular Formula:

C17H25 B O5

Molecular Weight:

320.19

Description

Carbonicacid, 1,1-dimethylethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylester is utilized in the biomedical industry for the drug development of various diseases. It exhibits potent therapeutic properties against specific targets, assisting in the management of specific health conditions.

Synonyms

4-TERT-BUTOXYCARBONYLOXYPHENYLBORONIC ACID, PINACOL ESTER; TERT-BUTYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYLCARBONATE; T-BUTYL 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL CARBONATE; tert-Butyl-4-(4,4,5,5-tetramethyl-1,3,2-; 4-t-Butox

IUPAC Name

tert-butyl [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] carbonate

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OC(=O)OC(C)(C)C

InChI

InChI=1S/C17H25BO5/c1-15(2,3)21-14(19)20-13-10-8-12(9-11-13)18-22-16(4,5)17(6,7)23-18/h8-11H,1-7H3

InChI Key

JUKMJUAVZLWOOZ-UHFFFAOYSA-N

Melting Point

107-111 °C (lit.)

Flash Point

Not applicable

Purity

95%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

320.1795041 g/mol

Monoisotopic Mass

320.1795041 g/mol

Topological Polar Surface Area

54Å²

Heavy Atom Count

Formal Charge

Complexity

417

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Carbonicacid, 1,1-dimethylethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylester

Product Information

Computed Properties

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