CAS 156006-28-9|3,4,5-Trifluorophenylmagnesium bromide|bromo(3,4,5-trifluorophenyl)magnesium|bromo(3,4,5-trifluorophenyl)magnesium|3,4,5-三氟苯基溴化镁溶液|3,4,5-Trifluorophenylmagnesium bromide so...

Molecular Formula

C₆H₂BrF₃Mg

Molecular Mass

235.2842896

Exact Mass

233.91423842

InChI

InChI=1S/C6H2F3.BrH.Mg/c7-4-2-1-3-5(8)6(4)9;;/h2-3H;1H;/q;;+1/p-1

InChIKey

RHOSOGQLMWAFJM-UHFFFAOYSA-M

Canonic Smiles

Br[Mg]c1cc(F)c(c(c1)F)F

Isomeric Smiles

[Mg](c1cc(c(c(c1)F)F)F)Br

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.2058

LogD (pH = 7.4)

2.2058

Log P

2.2058

Molar Refractivity

34.8587

Polarizability

14.7087

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

2778259

Synonyms

3,4,5-Trifluorophenylmagnesium bromide3,4,5-三氟苯基溴化镁溶液3,4,5-Trifluorophenylmagnesium bromide solution3,4,5-Trifluorophenylmagnesium bromide, 0.50 M in 2-MeTHF3,4,5-三氟苯基溴化镁, 0.50M 2-MeTHF溶液

IUPAC Traditional name

bromo(3,4,5-trifluorophenyl)magnesium

IUPAC name

bromo(3,4,5-trifluorophenyl)magnesium

MDL Number

MFCD01311471

PubChem SID

16208178424879971

CAS Number

156006-28-9

Storage Warning

Flammable

Air & Moisture Sensitive

GHS Precautionary statements

P210-P261-P280-P305+P351+P338-P310

P210-P241-P303+P361+P353-P305+P351+P338-P405-P501

GHS Pictograms

Corrosive to metals, category 1

Skin corrosion, categories 1A,1B,1C

Serious eye damage, category 1

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

UN Number

2924

UN2924

GHS Hazard statements

H225-H314-H335

H224-H314-H318-EUH014

European Hazard Symbols

Flammable (F)

Irritant (Xi)

Corrosive (C)

RID/ADR

UN 2924 3/PG 2

Supplemental Hazard Statements

May form explosive peroxides.

German water hazard class

Risk Statements

11-19-36/37/38

11-14-19-34

Hazard Class

Storage Temperature

2-8°C

Packing Group

MSDS Link

Download link

Safety Statements

16-26

8-16-26-36/37-39-43-45

GHS Signal Word

Danger

TSCA Listed

否

Product Information

Linear Formula

F3C6H2MgBr

Concentration

0.3 M in THF

0.50 M in 2-MeTHF

Physical Property

Density

0.975 g/mL at 25 °C

Flash Point

-17 °C

1.4 °F

Boiling Point

65 °C

No Data Available

Click here to submit data

No Data Available

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Sigma Aldrich

561797

Packaging
50 mL in Sure/Seal™
Legal Information
Product of Rieke® Metals, Inc.
Rieke is a registered trademark of Rieke Metals, Inc.

No Data Available

Click here to submit data

Academic Data

PubChem

2778259

Synonyms

IUPAC Traditional name

bromo(3,4,5-trifluorophenyl)magnesium

IUPAC name

bromo(3,4,5-trifluorophenyl)magnesium

MDL Number

MFCD01311471

PubChem SID

16208178424879971

CAS Number

156006-28-9

Safety Information

Product Information

Linear Formula

F3C6H2MgBr

Concentration

0.3 M in THF

0.50 M in 2-MeTHF

Physical Property

Density

0.975 g/mL at 25 °C

Flash Point

-17 °C

1.4 °F

Boiling Point

65 °C

Sigma Aldrich

561797

Packaging
50 mL in Sure/Seal™
Legal Information
Product of Rieke® Metals, Inc.
Rieke is a registered trademark of Rieke Metals, Inc.

No Data Available

Click here to submit data

Molecule

ID:95134