Tribromoacetaldehyde

Base Information

• Chemical Name: Tribromoacetaldehyde
• CAS No.: 115-17-3
• Deprecated CAS: 29986-20-7
• Molecular Formula: C2H Br3 O
• Molecular Weight: 280.741
• Hs Code.: 29130000
• European Community (EC) Number: 204-067-9
• NSC Number: 66406
• UNII: W2WDI7648E
• DSSTox Substance ID: DTXSID1021667
• Nikkaji Number: J2.466J
• Wikipedia: Bromal
• Wikidata: Q21050552
• ChEMBL ID: CHEMBL3189061
• Mol file: 115-17-3.mol

Synonyms:2,2,2-tribromoacetaldehyde;tribromoacetaldehyde

Chemical Property of Tribromoacetaldehyde

Chemical Property:

• Appearance/Colour: Clear, brown liquid.
• Vapor Pressure: 1.23mmHg at 25°C
• Melting Point: -57.5 °C
• Refractive Index: n20/D 1.584(lit.)
• Boiling Point: 173-174 ºC
• Flash Point: 65 ºC
• PSA: 17.07000
• Density: 2.665
• LogP: 2.02380
• Storage Temp.: Refrigerator (+4°C)
• Water Solubility.: Soluble in water
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 279.75570
• Heavy Atom Count: 6
• Complexity: 54.3

Purity/Quality:

99% ^*data from raw suppliers

Bromal >96.0%(GC) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T+,Xi,T
• Statements: 25-27-34
• Safety Statements: 26-28-36/37/39-45-28A

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Aldehydes
• Canonical SMILES: C(=O)C(Br)(Br)Br
• Uses: Organic synthesis.

Technology Process of Tribromoacetaldehyde

There total 25 articles about Tribromoacetaldehyde 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:

1,1-dibromo-2,2-diethoxy-ethane (761-17-1) + bromine (7726-95-6) → bromal (115-17-3) + dibromoacetaldehyde (3039-13-2) + 2,2-diethoxy-1,1,1-tribromo-ethane (374077-95-9) + ethyl dibromoacetate (617-33-4)

Guidance literature:

Prod 5:Aethylbromid;

Reference yield:

ethanol (64-17-5) → bromal (115-17-3) + carbon tetrabromide (558-13-4)

Guidance literature:

With bromine;

Reference yield:

bromine (7726-95-6) + 2-chloro-ethanol (107-07-3) → bromal (115-17-3) + Bromoform (75-25-2) + carbon tetrabromide (558-13-4)

Guidance literature:

upstream raw materials:

diethyl acetal

diethyl ether

ethanol

2,2,2-tribromo-1-ethoxy-ethanol

Downstream raw materials:

1,1,1-tribromo-2,2-bis-(4-fluoro-phenyl)-ethane

1,1,1-tribromo-2,2-bis-(4-bromo-phenyl)-ethane

phosphoric acid-(2,2-dibromo-vinyl ester)-diisopropyl ester

2-phenyl-butyric acid-(2,2,2-tribromo-1-hydroxy-ethylamide)

Refernces

• 1、 Yoshioka, Tadao,Krauser, Joel A,Guengerich, F Peter. "Microsomal oxidation of tribromoethylene and reactions of tribromoethylene oxide.". . p. 1414 - 1420. Retrieved 2002.
• 2、 Parker et al.. "". . p. 242. Retrieved 1970.
• 3、 -. "Process for functionalising a phenolic compound carrying an electron-donating group". . . Retrieved 2008/06/13.
• 4、 Mironov, V. F.,Konovalova, I. V.. "THERMAL DECOMPOSITION OF 1-CHLOROALKOXYPHOSPHORANES WITH PHENYLENEDIOXAPHOSPHOLANE RING". . p. 2297 - 2298. Retrieved 2007/10/02.