Phenethylmagnesium chloride

Basic Information

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CAS Number

90878-19-6

Molecular Formula

C8H9ClMg

Molecular Weight

164.92 g/mol

Basic Physical Properties

Boiling Point

65 °C

Density

0.954 g/mL at 25 °C

SMILES

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[CH2-]CC1=CC=CC=C1.[Mg+2].[Cl-]

InChI

InChI=1S/C8H9.ClH.Mg/c1-2-8-6-4-3-5-7-8;;/h3-7H,1-2H2;1H;/q;;+1/p-1

InChIKey

AZORNQXQALOFHH-UHFFFAOYSA-M

LogP

2.5054000000000007

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

60.3

Safety Information

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Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids

H302 Harmful if swallowed
Acute toxicity, oral

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

H351 Suspected of causing cancer
Carcinogenicity

Synonyms & References

English

Phenethylmagnesium chloride
Magnesium,chloro(2-phenylethyl)-
magnesium,ethylbenzene,chloride
Phenethylmagnesium chloride, 1.0 M solution in THF, SpcSeal
PhenethylMagnesiuM chloride, 1M solution in THF, AcroSeal
(2-Phenylethyl)magnesium chloride
Benzene, ethyl-, magnesium complex (ZCI)
Chloro(2-phenylethyl)magnesium (ACI)
90878-19-6
2-phenylethyl magnesium chloride
MFCD00192387
SCHEMBL45141
Phenethylmagnesium chloride, 1M (17% w/w) in THF
phenethyl magnesium chloride
PHENETHYLMAGNESIUM CHLORIDE
2-phenylethylmagnesium chloride
phenylethylmagnesium chloride
chloro(2-phenylethyl)magnesium
phenyethylmagnesium chloride
AZORNQXQALOFHH-UHFFFAOYSA-M
AKOS015888166
phenethymagnesium chloride
phenylethyl magnesium chloride

MDL Number

MFCD00192387

FAQ

What regulatory guidelines apply to Phenethylmagnesium chloride (CAS: 90878-19-6)?

Phenethylmagnesium chloride (CAS: 90878-19-6) is classified as a flammable liquid under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS). It is subject to the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulations in the EU. In the USA, it is regulated by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for safety and environmental protection. Ensure compliance with local and national regulations regarding handling, storage, and disposal.

Are there alternatives to Phenethylmagnesium chloride (CAS: 90878-19-6) in synthesis?

Alternatives to Phenethylmagnesium chloride (CAS: 90878-19-6) include other organomagnesium compounds like phenethylmagnesium bromide or tributyl magnesium, which can serve similar functions in organic synthesis. Additionally, nucleophilic substitution reagents such as Grignard reagents or organolithium reagents can be viable substitutes depending on the specific reaction conditions and desired products.

What is the market or research trend for Phenethylmagnesium chloride (CAS: 90878-19-6)?

Phenethylmagnesium chloride (CAS: 90878-19-6) remains a significant reagent in the synthesis of various organic compounds due to its nucleophilic nature. Research trends indicate an ongoing interest in its applications in medicinal chemistry and pharmaceuticals. Market analysis suggests a stable demand with minor fluctuations due to its versatile use in academic and industrial research. Innovations in synthetic methodologies continue to drive its application in emerging fields such as drug discovery and advanced materials.

How should waste containing Phenethylmagnesium chloride (CAS: 90878-19-6) be handled?

Waste containing Phenethylmagnesium chloride (CAS: 90878-19-6) should be handled by first neutralizing any residual magnesium chloride and then treating the waste with a non-flammable solvent. The solution should be collected in a suitable container and disposed of through a licensed hazardous waste disposal service. Always follow local regulations and ensure all safety precautions are taken, including proper ventilation and protective gear. Environmental protection measures should include minimizing the generation of waste and recycling where possible.