Benzoic acid ammonium salt

Base Information

• Chemical Name: Benzoic acid ammonium salt
• CAS No.: 1863-63-4
• Molecular Formula: C7H9NO2
• Molecular Weight: 139.154
• Hs Code.: 2916 31 00
• NSC Number: 7918
• UNII: AC80WD7GPF
• Wikidata: Q1529873
• NCI Thesaurus Code: C78761
• ChEMBL ID: CHEMBL2105970
• Mol file: 1863-63-4.mol

Synonyms:Benzoic acid ammonium salt;azane;benzoic acid;ammonia;NSC-7918;AC80WD7GPF;NSC7918;MFCD00013069;Ammonium benzoate, 98%;benzoic acid, ammonia salt;Benzoesaure Ammoniakflussigkeit;AMMONIUM BENZOATE [MI];SCHEMBL3664106;AMMONIUM BENZOATE [HSDB];AMMONIUM BENZOATE [INCI];CHEMBL2105970;AMMONIUM BENZOICUM [HPUS];AKOS037649040;CS-W016477;BS-16366;Q1529873

Chemical Property of Benzoic acid ammonium salt

Chemical Property:

• Appearance/Colour: White crystalline powder
• Vapor Pressure: 0.0486mmHg at 25°C
• Melting Point: 192-198 °C (dec.)(lit.)
• Refractive Index: 1.558
• Boiling Point: 249.3 °C at 760 mmHg
• Flash Point: 111.4 °C
• PSA: 40.54000
• Density: 1.197g/cm3
• LogP: 1.70870
• Storage Temp.: Store at +5°C to +30°C.
• Sensitive.: Moisture Sensitive
• Solubility.: H2O: 1 M at 20 °C, clear, colorless
• Water Solubility.: soluble
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 139.063328530
• Heavy Atom Count: 10
• Complexity: 104

Purity/Quality:

99% ^*data from raw suppliers

Ammonium benzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi
• Hazard Codes: Xn,Xi
• Statements: 22-36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)O.N
• Uses: To preserve glue and latex. Ammonium benzoate is used predominantly in industries which acts as a corrosion inhibitors and anti-scaling agents . It is also used as paint additives and coating additives. Other consumer uses include cleaning and furnishing Care products, paints and coatings, personal care products, water treatment products. Ammonium benzoate is also used as chemical analysis reagents, in electronics industry, used for the production of electrolytic capacitors and also used in pharmaceutical industries. Used as adhesives, metal rust treatment and rubber additives.

Technology Process of Benzoic acid ammonium salt

There total 4 articles about Benzoic acid ammonium salt which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 29.0%

1,2,3,4,6-penta-O-benzoyl-α-D-glucopyranose (22415-91-4) → 1,1-bis(benzamido)-6-O-benzoyl-1-deoxy-D-glucitol (15356-13-5) + ammonium benzoate (1863-63-4) + N-benzoyl-6-O-benzoyl-α-D-glucofuranosylamine (116143-85-2) + N-benzoyl-3,6-di-O-benzoyl-α-D-glucofuranosylamine (116143-92-1)

Guidance literature:

With ammonia; In 1,4-dioxane; chloroform; at -60 ℃; for 100h; Further byproducts given;

DOI:10.1016/0008-6215(87)85006-1

Reference yield:

→ ammonium benzoate (1863-63-4)

Guidance literature:

Reference yield:

benzonitrile (100-47-0) → ammonium benzoate (1863-63-4,21292-26-2,28271-83-2,143502-10-7)

Guidance literature:

With Potassium benzoate; In water; at 120 ℃; for 25h; Reagent/catalyst; Autoclave;

upstream raw materials:

benzoic acid

benzonitrile

1,2,3,4,6-penta-O-benzoyl-α-D-glucopyranose

Downstream raw materials:

p-bromobenzamidinium benzoate

[3-[tert-butyl(dimethyl)silyl]oxy-2-hydroxypropyl] benzoate

Benzoic acid (1S,3S)-1-((R)-1,2-dihydroxy-ethyl)-3,7-dimethyl-oct-6-enyl ester

(1S,2S)-benzoic acid 1-hydroxy-1,2-dihydronaphthalen-2-yl-ester

Refernces

• 1、 Yang, Wei-Wei,Di, You-Ying,Kong, Yu-Xia,Guo, Xiao-Yang,Tan, Zhi-Cheng. "Synthesis, characterization, and thermodynamic study of ammonium benzoate C7H5O2NH4(s)". experimental part. p. 14 - 19. Retrieved 2010/07/09.
• 2、 Salinas, Amelia E.,Sproviero, Jorge F.,Deulofeu, Venancio. "AMMONOLYSIS OF PENTA-O-BENZOYL-α-D-GLUCOPYRANOSE IN AN APROTIC MEDIUM. CHARACTERIZATION OF THE PRODUCTS ISOLATED, AND CONFORMATIONAL ANALYSIS OF ELEVEN N-BENZOYL-D-GLUCOFURANOSYLAMINE DERIVATIVES". . p. 71 - 99. Retrieved 2007/10/02.