chloro(methyl)zinc

• ChemBase ID: 145403
• Molecular Formular: CH3ClZn
• Molecular Mass: 115.86752
• Monoisotopic Mass: 113.92146978
• SMILES: C[Zn]Cl
• Canonical SMILES: C[Zn]Cl
• InChI: InChI=1S/CH3.ClH.Zn/h1H3;1H;/q;;+1/p-1
• InChIKey: ASUSLKVOTPUROZ-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: chloro(methyl)zinc
• IUPAC Traditional name: chloro(methyl)zinc
• Synonyms: Methylzinc chloride solution; 甲基氯化锌 溶液

Database IDs

• CAS Number: 5158-46-3
• MDL Number: MFCD00192334
• Beilstein Number: 969141
• PubChem SID: 24866136; 162239609
• PubChem CID: 4152418

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.3156
• LogD (pH = 7.4): 0.3156
• Log P: 0.3156
• Molar Refractivity: 11.9164 cm^3
• Polarizability: 7.9507413 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 67 °C
• Flash Point: 1.4 °F; -17 °C
• Density: 1.033 g/mL at 25 °C

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 1993
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11-19-34-37
• Safety Statements: 16-26-36/37/39-45
• GHS Pictograms: GHS02; GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H314-H335
• GHS Precautionary statements: P210-P261-P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 2
• Supplemental Hazard Statements: May form explosive peroxides.

Product Information

• Concentration: 2.0 M in THF
• Linear Formula: CH3ZnCl

DETAILS

Sigma Aldrich - 417297

Packaging
50 mL in Sure/Seal™