chloro(cyclopentyl)magnesium

• ChemBase ID: 149531
• Molecular Formular: C5H9ClMg
• Molecular Mass: 128.88296
• Monoisotopic Mass: 128.02431967
• SMILES: C1CCC(C1)[Mg]Cl
• Canonical SMILES: Cl[Mg]C1CCCC1
• InChI: InChI=1S/C5H9.ClH.Mg/c1-2-4-5-3-1;;/h1H,2-5H2;1H;/q;;+1/p-1
• InChIKey: GROGEABZCKQTJW-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: chloro(cyclopentyl)magnesium
• IUPAC Traditional name: chloro(cyclopentyl)magnesium
• Synonyms: Cyclopentylmagnesium chloride solution; 环戊基氯化镁 溶液

Database IDs

• CAS Number: 32916-51-1
• MDL Number: MFCD00001357
• Beilstein Number: 4124474
• PubChem SID: 162243696; 24853435
• PubChem CID: 3599845

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.434
• LogD (pH = 7.4): 1.434
• Log P: 1.434
• Molar Refractivity: 28.274 cm^3
• Polarizability: 13.052536 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: -40 °C; -40 °F
• Density: 0.878 g/mL at 25 °C

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 3399
• German water hazard class: 3
• Hazard Class: 4.3
• Packing Group: 1
• Risk Statements: 11-14/15-19-22-34-67
• Safety Statements: 16-26-36/37/39-43-45
• GHS Pictograms: GHS02; GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H261-H302-H314-H336
• GHS Precautionary statements: P210-P231 + P232-P261-P280-P305 + P351 + P338-P422
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3399 4.3/PG 1
• Supplemental Hazard Statements: May form explosive peroxides., Reacts violently with water.

Product Information

• Concentration: 2.0 M in diethyl ether
• Empirical Formula (Hill Notation): C5H9ClMg

DETAILS

Sigma Aldrich - 224405

Packaging
100, 800 mL in Sure/Seal™