4-Acetoxybutylzinc bromide

Inquiry

Molecular Formula:

H3CCO2(CH2)4ZnBr

Molecular Weight:

260.44

Product Information

Molecular Formula:

H3CCO2(CH2)4ZnBr

Molecular Weight:

260.44

Description

4-Acetoxybutylzinc bromide exhibits dual functionality as both a reactant and catalyst, fostering intricate biochemical reactions essential for the synthesis of tailor-made pharmaceutical agents.

Synonyms

Bromozinc(1+); butyl acetate; 4-Acetoxybutylzinc bromide 0.5 M in Tetrahydrofuran; 4-Acetoxybutylzinc bromide, 0.5M in THF; 4-Acetoxybutylzinc bromide, 0.5 M in THF

IUPAC Name

bromozinc(1+)butyl acetate

Canonical SMILES

CC(=O)OCCC[CH2-].[Zn+]Br

InChI

InChI=1S/C6H11O2.BrH.Zn/c1-3-4-5-8-6(2)7/h1,3-5H2,2H31H/q-1+2/p-1

InChI Key

ODWOBOIUYZOKOA-UHFFFAOYSA-M

Flash Point

1.4 °F - closed cup

Density

0.985 g/mL at 25 °C (lit.)

Storage

2-8°C

Safety Information

Hazards

H225 - H302 - H319 - H335 - H351

Precautionary Statement

P210 - P280 - P301 + P312 + P330 - P305 + P351 + P338 - P370 + P378 - P403 + P235

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

257.92338 g/mol

Monoisotopic Mass

257.92338 g/mol

Topological Polar Surface Area

26.3Å²

Heavy Atom Count

Formal Charge

Complexity

78.1

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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4-Acetoxybutylzinc bromide

Product Information

Safety Information

Computed Properties

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