(R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine

Base Information

• Chemical Name: (R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine
• CAS No.: 121788-73-6
• Molecular Formula: C16H14 F6 N2 O4 S2
• Molecular Weight: 476.41
• European Community (EC) Number: 679-835-3
• Nikkaji Number: J1.007.852K
• Wikidata: Q76146236
• Mol file: 121788-73-6.mol

Synonyms:121788-73-6;(R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine;N,N'-((1R,2R)-1,2-Diphenylethane-1,2-diyl)bis(1,1,1-trifluoromethanesulfonamide);N-[(1R,2R)-1,2-diphenyl-2-(trifluoromethylsulfonylamino)ethyl]-1,1,1-trifluoromethanesulfonamide;C16H14F6N2O4S2;(R,R)-N,N'-BIS(TRIFLUOROMETHYLSULFONYL)-1,2-DIPHENYLETHYLENEDIAMINE;SCHEMBL12789659;(R,R)-1,2-Bis(trifluoromethanesulfonamido)-1,2-diphenylethane;(r,r)-n,n-bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine;MFCD01321158;AKOS004902653;AKOS015853144;CS-W011529;SC11727;Methanesulfonamide, N,N'-[(1R,2R)-1,2-diphenyl-1,2-ethanediyl]bis[1,1,1-trifluoro-;DS-14755;D2520;C71813;A891397;(1R,2R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenyle thylenediamine;(R,R)-N,N'-BIS(TRIFLUOROMETHYLSULPHONYL)-1,2-DIPHENYLETHYLENEDIAMINE;N,N'-[(1R,2R)-1,2-Diphenylethylene]bis(trifluoromethanesulfonamide);N,N'-((1R,2R)-1,2-Diphenylethane-1,2-diyl)-bis(1,1,1-trifluoromethanesulfonamide);(R,R)-1,2-BIS(TRIFLUOROMETHANESULFONAMIDO)-1,2-DIPHENYLETHANE;(R,R)-N,N'-BIS(TRIFLUOROMETHANESULFONYL)-1,2-DIPHENYLETHYLENEDIAMINE

Chemical Property of (R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine

Chemical Property:

• Vapor Pressure: 1.51E-09mmHg at 25°C
• Melting Point: 213 °C
• Boiling Point: 484.6°C at 760 mmHg
• PKA: 4.15±0.40(Predicted)
• Flash Point: 246.9°C
• PSA: 109.10000
• Density: 1.537g/cm³
• LogP: 6.29080
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: soluble in Methanol
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 7
• Exact Mass: 476.02991825
• Heavy Atom Count: 30
• Complexity: 694

Purity/Quality:

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

(R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C(C2=CC=CC=C2)NS(=O)(=O)C(F)(F)F)NS(=O)(=O)C(F)(F)F
• Isomeric SMILES: C1=CC=C(C=C1)[C@H]([C@@H](C2=CC=CC=C2)NS(=O)(=O)C(F)(F)F)NS(=O)(=O)C(F)(F)F

Technology Process of (R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine

There total 1 articles about (R,R)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine 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%

trifluoromethane sulfonyl chloride (421-83-0) + (R,R)-1,2-diphenylethylenediamine (35132-20-8) → N-(1,2-diphenyl-2-trifluoromethanesulfonylaminoethyl)-C,C,C-trifluoromethanesulfonamide (121788-73-6)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 2h;

DOI:10.1002/adsc.200404168

Reference yield:

N-(1,2-diphenyl-2-trifluoromethanesulfonylaminoethyl)-C,C,C-trifluoromethanesulfonamide (121788-73-6) → (4R,5R)-2-Chloro-4,5-diphenyl-1,3-bis-trifluoromethanesulfonyl-[1,3,2]diazaphospholidine

Guidance literature:

With triethylamine; phosphorus trichloride; In toluene; at -78 - 20 ℃;

DOI:10.1002/adsc.200404168

Reference yield:

N-(1,2-diphenyl-2-trifluoromethanesulfonylaminoethyl)-C,C,C-trifluoromethanesulfonamide (121788-73-6) → (4R,5R)-2-[1-((S)-4-tert-Butyl-4,5-dihydro-oxazol-2-yl)-1-methyl-ethoxy]-4,5-diphenyl-1,3-bis-trifluoromethanesulfonyl-[1,3,2]diazaphospholidine

Guidance literature:

Multi-step reaction with 2 steps

1: PCl₃; Et₃N / toluene / -78 - 20 °C

2: Et₃N; DMAP / toluene / -78 - 20 °C

With dmap; triethylamine; phosphorus trichloride; In toluene;

DOI:10.1002/adsc.200404168

upstream raw materials:

trifluoromethane sulfonyl chloride

(R,R)-1,2-diphenylethylenediamine

Refernces