bromo(6-methylpyridin-2-yl)zinc

• ChemBase ID: 148804
• Molecular Formular: C6H6BrNZn
• Molecular Mass: 237.40254
• Monoisotopic Mass: 234.8975032
• SMILES: Cc1cccc(n1)[Zn]Br
• Canonical SMILES: Br[Zn]c1cccc(n1)C
• InChI: InChI=1S/C6H6N.BrH.Zn/c1-6-4-2-3-5-7-6;;/h2-4H,1H3;1H;/q;;+1/p-1
• InChIKey: PHXNJPJTSMRASQ-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: bromo(6-methylpyridin-2-yl)zinc
• IUPAC Traditional name: bromo(6-methylpyridin-2-yl)zinc
• Synonyms: 6-Methyl-2-pyridylzinc bromide solution; 6-Methyl-2-pyridylzinc bromide, 0.5M in THF; 6-甲基-2-吡啶溴化锌 溶液

Database IDs

• CAS Number: 308795-98-4
• EC Number: 203-726-8
• MDL Number: MFCD01311462
• PubChem SID: 162242978; 24873247
• PubChem CID: 16132943

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.9681546
• LogD (pH = 7.4): 1.7223871
• Log P: 1.7496
• Molar Refractivity: 36.9576 cm^3
• Polarizability: 17.404232 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: 1.4 °F; -17 °C
• Density: 0.996; 0.996 g/mL at 25 °C

Safety Information

• Storage Warning: Air Sensitive
• European Hazard Symbols: Corrosive (C); Flammable (F); Irritant (Xi)
• UN Number: 3399; UN3399
• German water hazard class: 3
• Hazard Class: 4.3
• Packing Group: 2; II
• Risk Statements: 11-15-19-34-37; 11-19-36/37
• Safety Statements: 16-29-33; 7/8-9-16-20-23-26-33-36/37/39-43-45-60
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H224-H260-H314-H318-H335; H225-H319-H335
• GHS Precautionary statements: P210-P231+P232-P303+P361+P353-P305+P351+P338-P405-P501; P210-P261-P305 + P351 + P338
• RID/ADR: UN 3399 4.3/PG 2
• Supplemental Hazard Statements: May form explosive peroxides.
• 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
• Empirical Formula (Hill Notation): C6H6BrNZn

DETAILS

Sigma Aldrich - 499013

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