Cyclopropylzinc bromide solution

Inquiry

Molecular Formula:

C3H5BrZn

Molecular Weight:

186.37

CAS Number:

126403-68-7

Catalog Number:

126403-68-7

Product Information

Molecular Formula:

C3H5BrZn

Molecular Weight:

186.37

Description

Active nucleophile in Pd-catalyzed cross-coupling of heteroaryl halides.

Synonyms

zinc; cyclopropane; bromide; CYCLOPROPYLZINCBROMIDE; bromo(cyclopropyl)zinc; cyclopropylzincbromide

IUPAC Name

bromozinc(1+)cyclopropane

Canonical SMILES

C1C[CH-]1.[Zn+2].[Br-]

InChI

InChI=1S/C3H5.BrH.Zn/c1-2-3-1;;/h1H,2-3H2;1H;/q-1;;+2/p-1

InChI Key

IKVDXUFZJARKPF-UHFFFAOYSA-M

Flash Point

1.4 °F - closed cup

Purity

95%

Density

0.969 g/mL at 25°C

Storage

2-8°C

Safety Information

Hazards

H225 - H302 - H314 - H335 - H351

Precautionary Statement

P201 - P210 - P233 - P280 - P303 + P361 + P353 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

183.88660 g/mol

Monoisotopic Mass

183.88660 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

14.4

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

Patents

Publication Number	Title	Priority Date
US-2011112127-A1	Compounds and methods for kinase modulation, and indications therefor	2009-11-06
US-2009062290-A1	Heterocycles as potassium channel modulators	2007-08-17
US-2010240663-A1	Heterocycles as potassium channel modulators	2007-08-17

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