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N,N',N''-Tritosyldiethylenetriamine
[CAS# 56187-04-3]

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Identification
Name N,N',N''-Tritosyldiethylenetriamine
Synonyms Nsc245019; Nsc249331; 4-Methyl-N-(2-(((4-Methylphenyl)Sulfonyl)(2-(((4-Methylphenyl)Sulfonyl)Amino)Ethyl)Amino)Ethyl)Benzenesulfonamide
Molecular Structure CAS#: 56187-04-3, N,N',N''-Tritosyldiethylenetriamine
Molecular Formula C25H31N3O6S3
Molecular Weight 565.72
CAS Registry Number 56187-04-3
SMILES C3=C([S](N(CCN[S](C1=CC=C(C=C1)C)(=O)=O)CCN[S](C2=CC=C(C=C2)C)(=O)=O)(=O)=O)C=CC(=C3)C
InChI 1S/C25H31N3O6S3/c1-20-4-10-23(11-5-20)35(29,30)26-16-18-28(37(33,34)25-14-8-22(3)9-15-25)19-17-27-36(31,32)24-12-6-21(2)7-13-24/h4-15,26-27H,16-19H2,1-3H3
InChIKey OCDIAWYQMCPHAM-UHFFFAOYSA-N
Properties
Density 1.326g/cm3 (Cal.)
Melting point 177°C (Expl.)
Boiling point 736.939°C at 760 mmHg (Cal.)
Flash point 399.487°C (Cal.)
Safety Data
SDS Available
References
(1) Wilson Jennifer M.. Synthesis, characterisation and anti-protozoal activity of carbamate-derived polyazamacrocycles, Organic & Biomolecular Chemistry, 2007
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