CAS 307496-32-8|bromo[(2,5-difluorophenyl)methyl]zinc|2,5-二氟苄基溴化锌溶液|2,5-Difluorobenzylzinc bromide solution|2,5-Difluorobenzylzinc bromide 0.5M solution in THF|bromo[(2,5-difluorophenyl)me...

Molecular Formula

C₇H₅BrF₂Zn

Molecular Mass

272.3954064

Exact Mass

269.8834106

InChI

InChI=1S/C7H5F2.BrH.Zn/c1-5-4-6(8)2-3-7(5)9;;/h2-4H,1H2;1H;/q;;+1/p-1

InChIKey

VZULWCCPBONIMY-UHFFFAOYSA-M

Canonic Smiles

Fc1ccc(cc1C[Zn]Br)F

Isomeric Smiles

[Zn](Cc1c(ccc(c1)F)F)Br

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.6366

LogD (pH = 7.4)

2.6366

Log P

2.6366

Molar Refractivity

39.5329

Polarizability

18.074034

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

2778916

IUPAC name

bromo[(2,5-difluorophenyl)methyl]zinc

Synonyms

2,5-二氟苄基溴化锌溶液2,5-Difluorobenzylzinc bromide solution2,5-Difluorobenzylzinc bromide 0.5M solution in THF

IUPAC Traditional name

bromo[(2,5-difluorophenyl)methyl]zinc

MDL Number

MFCD01311422

CAS Number

307496-32-8

PubChem SID

16208655524874220

Physical Property

Flash Point

-17°C

1.4 °F

-17 °C

Density

0.993 g/mL at 25 °C

Storage Warning

Flammable/Keep Cold/Store under Argon

Risk Statements

11-19-36/37

P210-P261-P305+P351+P338

UN 2056 3/PG 2

H225-H319-H335

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

May form explosive peroxides.

Product Information

0.5 M in THF

F2C6H3CH2ZnBr

No Data Available

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No Data Available

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Sigma Aldrich

521663

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

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Academic Data

PubChem

2778916

IUPAC name

bromo[(2,5-difluorophenyl)methyl]zinc

Synonyms

2,5-二氟苄基溴化锌溶液2,5-Difluorobenzylzinc bromide solution2,5-Difluorobenzylzinc bromide 0.5M solution in THF

IUPAC Traditional name

bromo[(2,5-difluorophenyl)methyl]zinc

MDL Number

CAS Number

PubChem SID

521663

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

Physical Property

Flash Point

-17°C

1.4 °F

-17 °C

Density

0.993 g/mL at 25 °C

Safety Information

Product Information

0.5 M in THF

F2C6H3CH2ZnBr

Irritant (Xi)

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

Molecule

ID:100577