Ethyl 4-bromobenzoate , ≥98.0%(GC) , 5798-75-4

CAS NO.：5798-75-4

Empirical Formula: C9H9BrO2

Molecular Weight: 229.07

MDL number: MFCD00016329

EINECS: 227-347-2

PRODUCT Properties

• Melting point: 18 °C
• Boiling point: 131 °C/14.3 mmHg
• Density: 1.43
• refractive index: 1.55
• Flash point: > 113 °C - closed cup
• storage temp.: Sealed in dry,Room Temperature
• form: clear liquid
• color: Colorless to Light yellow to Light orange
• Specific Gravity: 1.403
• Water Solubility: Insoluble
• Merck: 14,1408
• BRN: 1867129
• InChI: 1S/C9H9BrO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3
• InChIKey: XZIAFENWXIQIKR-UHFFFAOYSA-N
• SMILES: CCOC(=O)c1ccc(Br)cc1
• CAS DataBase Reference: 5798-75-4(CAS DataBase Reference)
• NIST Chemistry Reference: Benzoic acid, 4-bromo-, ethyl ester(5798-75-4)
• EPA Substance Registry System: Benzoic acid, 4-bromo-, ethyl ester (5798-75-4)

Description and Uses

Ethyl 4-bromobenzoate undergoes reduction with potassium diisobutyl-t-butoxyaluminum hydride (PDBBA) at 0°C to yield aldehydes. Reaction of ethyl 4-bromobenzoate and substituted benzyl chloride with zinc dust and a Pd catalyst is reported.

Safety

• Symbol(GHS): GHS05,GHS02
• Signal word: Danger
• Hazard statements: H314-H225
• Precautionary statements: P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405
• PPE: Eyeshields, Gloves
• Hazard Codes: Xi,N
• Risk Statements: 36/37/38-51/53
• Safety Statements: 24/25-61
• RIDADR: UN 3082 9 / PGIII
• WGK Germany: 3
• Hazard Note: Irritant
• TSCA: TSCA listed
• HS Code: 29163990
• Storage Class: 10 - Combustible liquids