4-Iodobenzoyl chloride, 98%

Description

CAS: 1711-02-0 | C7H4ClIO | 266.462 g/mol

4-Iodobenzoyl chloride is employed in the preparation of pyrroles by reaction with imines and acetylenes mediated by isocyanides using palladium catalysis. It is also used in the preparation of N-(1-benzylpyrrolidin-3-yl)arylbenzamides, potential human dopamine D₄ antagonists. Further, it is used to prepare [2]rotaxane monomer and poly[2] rotaxane. In addition to this, it is important in the modification of poly(allylamine) in order to make the polymer X-ray visible.

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

Applications
4-Iodobenzoyl chloride is employed in the preparation of pyrroles by reaction with imines and acetylenes mediated by isocyanides using palladium catalysis. It is also used in the preparation of N-(1-benzylpyrrolidin-3-yl)arylbenzamides, potential human dopamine D₄ antagonists. Further, it is used to prepare [2]rotaxane monomer and poly[2] rotaxane. In addition to this, it is important in the modification of poly(allylamine) in order to make the polymer X-ray visible.

Solubility
Soluble in toluene and benzene.

Notes
Moisture sensitive. Incompatible with strong bases and water.

Specifications

Chemical Identifiers

• CAS: 1711-02-0
• Molecular Formula: C7H4ClIO
• Molecular Weight (g/mol): 266.462
• MDL Number: MFCD00001058
• InChI Key: NJAKCIUOTIPYED-UHFFFAOYSA-N
• Synonym: p-iodobenzoyl chloride, benzoyl chloride, 4-iodo, benzoyl chloride, p-iodo, 4-iodobenzoic acid chloride, 4-iodobenzoylchloride, 4-iodo-benzoyl chloride, 4iodobenzoyl chloride, 4-iodo-benzoylchlorid, rho-iodobenzoyl chloride, 4-iodo benzoyl chloride
• PubChem CID: 74373
• IUPAC Name: 4-iodobenzoyl chloride
• SMILES: C1=CC(=CC=C1C(=O)Cl)I

• Melting Point: 61°C to 65°C
• Boiling Point: 120°C to 121°C (1 mmHg)
• Flash Point: >110°C (230°F)
• Quantity: 5 g
• UN Number: UN3261
• Beilstein: 774718
• Sensitivity: Light and moisture sensitive
• Solubility Information: Soluble in toluene and benzene.
• Formula Weight: 266.47
• Percent Purity: 98%
• Chemical Name or Material: 4-Iodobenzoyl chloride

Safety and Handling

Hazard Category	H314
Hazard Statement	GHS H Statement H314-H318 Causes severe skin burns and eye damage. Causes serious eye damage.
Precautionary Statement	P260-P264b-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P501c
DOTInformation	Hazard Class: 8; Packaging Group: III
EINECSNumber	216-974-7
TSCA	Yes
Recommended Storage	Ambient temperatures

SDS

RUO – Research Use Only