Methyl pentafluorobenzoate, 99%

Description

CAS: 36629-42-2 | C8H3F5O2 | 226.10 g/mol

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Specifications

Chemical Identifiers

• CAS: 36629-42-2
• Molecular Formula: C8H3F5O2
• Molecular Weight (g/mol): 226.10
• MDL Number: MFCD00012172
• InChI Key: UXJRQNXHCZKHRJ-UHFFFAOYSA-N
• Synonym: methyl pentafluorobenzoate, pentafluorobenzoic acid methyl ester, benzoic acid, pentafluoro-, methyl ester, benzoic acid,2,3,4,5,6-pentafluoro-, methyl ester, methylpentafluorobenzoate, methyl perfluorobenzoate, acmc-209inq, methyl pentafluorbenzoate, perfluorobenzoic acid methyl ester
• PubChem CID: 606853
• IUPAC Name: methyl 2,3,4,5,6-pentafluorobenzoate
• SMILES: COC(=O)C1=C(F)C(F)=C(F)C(F)=C1F

• Density: 1.5300g/mL
• Boiling Point: 87.0°C to 88.0°C (20.0 mmHg)
• Flash Point: 78°C
• Infrared Spectrum: Authentic
• Assay Percent Range: 98.5% min. (GC)
• Packaging: Glass bottle
• Refractive Index: 1.4300 to 1.4320
• Linear Formula: F₅C₆CO₂CH₃
• Quantity: 5 g
• Specific Gravity: 1.53
• Formula Weight: 226.1
• Percent Purity: 99%
• Chemical Name or Material: Methyl pentafluorobenzoate

Safety and Handling

Hazard Category	GHS Signal Word: Warning
Hazard Statement	GHS H Statement Causes skin irritation. Causes serious eye irritation. May cause respiratory irritation.
Precautionary Statement	GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing. Call a POISON CENTER or doctor/physician if you feel unwell. If skin irritation occurs: Get medical advice/attention. If eye irritation persists: Get medical advice/attention.

SDS

RUO – Research Use Only