234621

Methyl 3-chlorobenzoate

98%

• Linear Formula: ClC₆H₄CO₂CH₃
• CAS Number: 2905-65-9
• Molecular Weight: 170.59
• EC Number: 220-814-1
• MDL number: MFCD00000592
• UNSPSC Code: 12352100
• PubChem Substance ID: 24854050
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 98%
• form: solid
• refractive index: n20/D 1.531 (lit.)
• bp: 99-101 °C/12 mmHg (lit.)
• mp: 21 °C (lit.)
• density: 1.227 g/mL at 25 °C (lit.)
• functional group: chloro; ester
• SMILES string: COC(=O)c1cccc(Cl)c1
• InChI: 1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
• InChI key: XRDRKVPNHIWTBX-UHFFFAOYSA-N

Description

General description

The (1+1) Resonance Enhanced Multiphoton Ionisation (REMPI) spectrum and the fluorescence excitation spectrum of methyl 3-chlorobenzoate has been measured in the supersonic free jet. Reaction of methyl 3-chlorobenzoate with lithium diisobutyl-t-butoxyaluminum hydride (LDBBA) has been investigated.

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: 219.2 °F - closed cup
• flash_point_c: 104.00 °C - closed cup
• ppe: Eyeshields, Gloves, type N95 (US)