O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride

Base Information

• Chemical Name: O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride
• CAS No.: 68401-66-1
• Molecular Formula: C₂H₄F₃NO*ClH
• Molecular Weight: 151.516
• Hs Code.: 2922199090
• European Community (EC) Number: 804-085-2
• DSSTox Substance ID: DTXSID80600623
• Mol file: 68401-66-1.mol

Synonyms:O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride;68401-66-1;2,2,2-Trifluoroethoxyamine hydrochloride;O-(2,2,2-trifluoroethyl)hydroxylamine;hydrochloride;MFCD13196692;O-(2,2,2-Trifluoroethyl)hydroxylamine HCl;C2H5ClF3NO;SCHEMBL1769169;DTXSID80600623;Hydroxylamine, O-(2,2,2-trifluoroethyl)-, hydrochloride;AKOS015900128;CS-0106188;D76609;EN300-110078;A934816;O-(2,2,2-trifluoroethyl)hydroxylamine,hydrochloride;O-(2,2,2-Trifluoroethyl)hydroxylaminehydrochloride;O-(2,2,2-Trifluoroethyl)hydroxylamine--hydrogen chloride (1/1)

Chemical Property of O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride

Chemical Property:

• Vapor Pressure: 20.4mmHg at 25°C
• Melting Point: 161-163°C
• Boiling Point: 112oC at 760 mmHg
• Flash Point: 21.5oC
• PSA: 35.25000
• LogP: 1.94130
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 151.0011760
• Heavy Atom Count: 8
• Complexity: 51.4

Purity/Quality:

98%,99%, ^*data from raw suppliers

O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride 93% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(F)(F)F)ON.Cl

Technology Process of O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride

There total 1 articles about O-(2,2,2-Trifluoroethyl)hydroxylamine hydrochloride 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: 61.0%

N-(2,2,2-trifluoroethoxy)phthalimide → 2,2,2-Trifluoroethoxyamine hydrochloride (68401-66-1)

Guidance literature:

N-(2,2,2-trifluoroethoxy)phthalimide; With hydrazine hydrate; In methanol; dichloromethane; at 20 ℃;

With hydrogenchloride; In ethanol;

DOI:10.7164/antibiotics.53.1071

Reference yield:

benzyl acetoacetate (5396-89-4) + 2,2,2-Trifluoroethoxyamine hydrochloride (68401-66-1) → cis-benzyl 3-((2,2,2-trifluoroethoxy)imino)butanoate (1372793-65-1) + trans-benzyl 3-((2,2,2-trifluoroethoxy)imino)butanoate

Guidance literature:

With pyridine; at 20 ℃; for 3h; optical yield given as %de;

DOI:10.1039/c2cc30490b

Downstream raw materials:

cis-benzyl 3-((2,2,2-trifluoroethoxy)imino)butanoate

Refernces

• 1、 Ishikawa,Kamiyama,Matsunaga,Tawada,Iizawa,Okonogi,Miyake. "Studies on anti-MRSA parenteral cephalosporins II. Synthesis and antibacterial activity of 7 β-[2-(5-Amino-1,2,4-thiadiazol-3-yl)- 2(Z)-alkoxyiminoacetamido]-3(substituted imidazo[1,2-b] pyridazinium-1-yl)methyl-3-cephem-4-carboxylates and related compounds". . p. 1071 - 1085. Retrieved 2007/10/03.