bromo(phenyl)zinc

• ChemBase ID: 145002
• Molecular Formular: C6H5BrZn
• Molecular Mass: 222.3879
• Monoisotopic Mass: 219.88660416
• SMILES: c1ccc(cc1)[Zn]Br
• Canonical SMILES: Br[Zn]c1ccccc1
• InChI: InChI=1S/C6H5.BrH.Zn/c1-2-4-6-5-3-1;;/h1-5H;1H;/q;;+1/p-1
• InChIKey: LMUFDZHWZIRZOY-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: bromo(phenyl)zinc
• IUPAC Traditional name: bromo(phenyl)zinc
• Synonyms: Phenylzinc bromide solution; Phenylzinc bromide, 0.5M in THF; 苯基溴化锌 溶液

Database IDs

• CAS Number: 38111-44-3
• MDL Number: MFCD01319861
• PubChem SID: 162239212; 24874439
• PubChem CID: 11138729

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.1923
• LogD (pH = 7.4): 2.1923
• Log P: 2.1923
• Molar Refractivity: 34.2095 cm^3
• Polarizability: 16.45762 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 65 °C
• Flash Point: 1.4 °F; -17 °C
• Density: 0.99; 0.99 g/mL at 25 °C

Safety Information

• Storage Warning: Air Sensitive
• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 3399; UN3399
• German water hazard class: 1
• Hazard Class: 4.3
• Packing Group: 2; II
• Risk Statements: 11-14-19-34; 11-14-19-34-37
• Safety Statements: 16-26-36/37/39-45; 8-9-12-16-26-30-33-36/37/39-45-60
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H261-H314; H225-H314-H335
• GHS Precautionary statements: P210-P231+P232-P303+P361+P353-P305+P351+P338-P405-P501A; P210-P261-P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US)
• RID/ADR: UN 3399 4.3/PG 2
• Supplemental Hazard Statements: May form explosive peroxides., Reacts violently with water.
• Storage Temperature: 2-8°C

Product Information

• Concentration: 0.5 M in THF; 0.5M in THF
• Packaging: packaged under Argon in resealable ChemSeal? bottles
• Linear Formula: C6H5ZnBr

DETAILS

Sigma Aldrich - 524719

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