993-04-4

Basic information

• Product Name: ACETIC ACID, SODIUM SALT, [1-14C]
• Synonyms: ACETIC ACID, SODIUM SALT, [1-14C];ACETIC ACID-1-14C SODIUM SALT;[1-14C]ACETIC ACID, SODIUM SALT;SODIUM ACETATE 1-14C
• CAS NO: 993-04-4
• Molecular Formula: C₂H₃O₂*Na
• Molecular Weight: 84.05
• Mol File: 993-04-4.mol
• Article Data: 1

Chemical Properties

• Appearance: /aqueous solution
• Storage Temp.: 2-8°C
• CAS DataBase Reference: ACETIC ACID, SODIUM SALT, [1-14C](CAS DataBase Reference)
• NIST Chemistry Reference: ACETIC ACID, SODIUM SALT, [1-14C](993-04-4)
• EPA Substance Registry System: ACETIC ACID, SODIUM SALT, [1-14C](993-04-4)

Safety Data

• RIDADR: UN 2910 7
• WGK Germany: 3
• Hazardous Substances Data: 993-04-4(Hazardous Substances Data)

Usage

InChI:InChI=1/C2H4O2.Na/c1-2(3)4;/h1H3,(H,3,4);/q;+1/p-1/i2+2;

Upstream product

• 1882-53-7 barium [14-C]carbonate 
• 917-64-6 methyl magnesium iodide 
• 51-90-1 [14C]carbon dioxide 

Downstream Products

• 676-77-7 [1-¹⁴C]acetyl chloride 
• 220167-83-9 2'-triethylsilyl-7-(-acetyl)paclitaxel 
• 27569-23-9 [1-14C]ethyl acetate 
• 2845-03-6 ¹⁴C-acetic acid 
• 5821-66-9 acetophenone 
• 4561-20-0 1-C¹⁴-Acetylbromid 

Relevant articles and documents

Synthesis of deramciclane labelled with radiocarbon in various positions

[U-14C]Bromobenzene, prepared from [14C]barium carbonate according to literature procedures, was transformed (Li/diethylether) into [14C]phenyllithium which was condensed with camphor giving rise to [U-14C-phenyl]borneol: 2. The latter, after conversion into its sodium sail, was reacted with dimethylaminoethyl chloride to give [14C-Ar]Deramciclane, which was isolated as the fumarate salt. This 8 step synthesis from [14C]BaCO3 gave an overall yield of 12%. [1-14C]Sodium acetate, through a standard 5 step literature procedure, was converted to N,N-dimethylaminoethyl-1-14C chloride 5 which was condensed with the sodium derivative of 2-phenylborneol giving rise to [1-14C-side chain]Deramciclane, again isolated as the fumarate. This 6 step synthesis from [14C]BaCO3 gave an overall yield of 8%. The specific radioactivities from the two syntheses were respectively 40 mCi/mmol and 21 mCi/mmol; chemical and radiochemical purities were better than 98%.