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2'-(Di-tert-butylphosphino)acetophenone ethylene ketal

2'-(Di-tert-butylphosphino)acetophenone ethylene ketal

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Molecular Formula:

C18H29O2P

Molecular Weight:

308.40

CAS Number:

1202864-99-0

Catalog Number:

1202864-99-0

Product Information

Molecular Formula:

C18H29O2P

Molecular Weight:

308.40

Description

2'-(Di-tert-butylphosphino)acetophenone ethylene ketal, in the realm of oncology research, is a biochemical compound of significance. Operating as an intermediate in the complex synthesis of an array of anti-cancer drugs, it aid in targeting an assortment of cancer cell lines, thereby facilitating efficacy in therapeutic endeavors.

Synonyms

2-(2-Di-tert-butylphosphinophenyl)-2-methyl-1,3-dioxolane,Bis(1,1-dimethylethyl)[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]-phosphine

IUPAC Name

ditert-butyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane

Canonical SMILES

CC1(OCCO1)C2=CC=CC=C2P(C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C18H29O2P/c1-16(2,3)21(17(4,5)6)15-11-9-8-10-14(15)18(7)19-12-13-20-18/h8-11H,12-13H2,1-7H3

InChI Key

QXUUTILKIBBBDF-UHFFFAOYSA-N

Melting Point

85-89 °C

Purity

97%

Safety Information

Hazards

H413

Computed Properties

XLogP3

3.1

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

308.19051716 g/mol

Monoisotopic Mass

308.19051716 g/mol

Topological Polar Surface Area

18.5Å²

Heavy Atom Count

Formal Charge

Complexity

333

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'-(Di-tert-butylphosphino)acetophenone ethylene ketal

Product Information

Safety Information

Computed Properties

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