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Cross-Coupling Reaction Catalyst
2,2-Dimethyl-1-(6-(4,4,5,5-tetramethyl-1,3,2-dioxa borolan-2-yl)-3,4-dihydro-1,8-naphthyridin-1(2H)-yl)propan-1-one

2,2-Dimethyl-1-(6-(4,4,5,5-tetramethyl-1,3,2-dioxa borolan-2-yl)-3,4-dihydro-1,8-naphthyridin-1(2H)-yl)propan-1-one

Inquiry

Molecular Formula:

C19H29BN2O3

Molecular Weight:

344.27

CAS Number:

1222533-83-6

Catalog Number:

1222533-83-6

Product Information

Molecular Formula:

C19H29BN2O3

Molecular Weight:

344.27

Description

2,2-Dimethyl-1-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-1,8-naphthyridin-1(2H )-yl)propan-1-one serves as an important pivot for the synthesis of indispensable drug derivatives, especially in the field of malignant tumor drug production. Utilizing a special structure, it facilitates efficient conjugation to designated molecular targets.

Synonyms

2,2-dimethyl-1-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]propan-1-one; 1222533-83-6; 2,2-Dimethyl-1-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-1,8-naphthyridin-1(2H)-yl)propan-1-one; (8-Pivaloyl-5,6,7,8-tetrahydro-1,8-naphthyridin-3-yl)boronicacidpinacolester; AC1Q1LLF; CTK8E2299

IUPAC Name

2,2-dimethyl-1-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]propan-1-one

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N=C2)N(CCC3)C(=O)C(C)(C)C

InChI

InChI=1S/C19H29BN2O3/c1-17(2,3)16(23)22-10-8-9-13-11-14(12-21-15(13)22)20-24-18(4,5)19(6,7)25-20/h11-12H,8-10H2,1-7H3

InChI Key

LVERYMRCXQZLII-UHFFFAOYSA-N

Flash Point

Not applicable

Purity

95%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

344.2271230 g/mol

Monoisotopic Mass

344.2271230 g/mol

Topological Polar Surface Area

51.7Å²

Heavy Atom Count

Formal Charge

Complexity

513

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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2,2-Dimethyl-1-(6-(4,4,5,5-tetramethyl-1,3,2-dioxa borolan-2-yl)-3,4-dihydro-1,8-naphthyridin-1(2H)-yl)propan-1-one

Product Information

Computed Properties

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