3,4-Dimethoxybenzylzinc chloride solution

Inquiry

Molecular Formula:

(CH3O)2C6H3CH2ZnCl

Molecular Weight:

252.03

CAS Number:

307531-79-9

Catalog Number:

307531-79-9

Product Information

Molecular Formula:

(CH3O)2C6H3CH2ZnCl

Molecular Weight:

252.03

Description

3,4-Dimethoxybenzylzinc chloride solution is a biologically active compound that is widely used in drug research for malignant diseases such as cancer, inflammation, and cardiovascular disease.

Synonyms

3,4-dimethoxybenzylzinc chloride; Zinc, chloro[(3,4-dimethoxyphenyl)methyl]-; 3,4-Dimethoxybenzylzinc chloride 0.5 M in Tetrahydrofuran; 3,4-Dimethoxybenzylzinc chloride, 0.5M in tetrahydrofuran

IUPAC Name

chlorozinc(1+)4-methanidyl-1,2-dimethoxybenzene

Canonical SMILES

COC1=C(C=C(C=C1)[CH2-])OC.Cl[Zn+]

InChI

InChI=1S/C9H11O2.ClH.Zn/c1-7-4-5-8(10-2)9(6-7)11-3/h4-6H,1H2,2-3H31H/q-1+2/p-1

InChI Key

NSGGLZPCWTUMDD-UHFFFAOYSA-M

Boiling Point

65 °C

Flash Point

1.4 °F - closed cup

Density

0.968 g/mL at 25 °C

Storage

2-8°C

Safety Information

Hazards

H225 - H261 - H302 - H315 - H319 - H335 - H351

Precautionary Statement

P210 - P231 + P232 - P280 - P370 + P378 - P402 + P404 - P403 + P235

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

249.973899 g/mol

Monoisotopic Mass

249.973899 g/mol

Topological Polar Surface Area

18.5Å²

Heavy Atom Count

Formal Charge

Complexity

124

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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3,4-Dimethoxybenzylzinc chloride solution

Product Information

Safety Information

Computed Properties

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