Vitas-M small molecule compound

N~2~,N~2~,N~4~,N~4~,N~6~,N~6~-hexabenzyl-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine-2,2,4,4,6,6-hexamine

Catalog ID
STK727042
SMILES c1ccc(cc1)CNP1(=NP(=NP(=N1)(NCc1ccccc1)NCc1ccccc1)(NCc1ccccc1)NCc1ccccc1)NCc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C42H48N9P3 MW 771.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H48N9P3/c1-7-19-37(20-8-1)31-43-52(44-32-38-21-9-2-10-22-38)49-53(45-33-39-23-11-3-12-24-39,46-34-40-25-13-4-14-26-40)51-54(50-52,47-35-41-27-15-5-16-28-41)48-36-42-29-17-6-18-30-42/h1-30,43-48H,31-36H2
InChIKey
PQIPDHTUQXNJAA-UHFFFAOYSA-N
Synonyms

2N2N4N4N6N6Nhexabenzyl1352$l^(5)4$l^(5)6$l^(5)triazatriphosphinine224466hexamine
2N2N4N4N6N6NHEXABENZYL135TRIAZA2
2N2N4N4N6N6Nhexabenzyl135triaza2$l^(5)4$l^(5)6$l^(5)triphosphacyclohexa135triene224466hexamine
C1=CC=C(C=C1)CNP2(=NP(=NP(=N2)(NCC3=CC=CC=C3)NCC4=CC=CC=C4)(NCC5=CC=CC=C5)NCC6=CC=CC=C6)NCC7=CC=CC=C7
InChI=1SC42H48N9P3c171937(2081)314352(4432382192102238)4953(4533392311312243946344025134142640)5154(505247354127155162841)48364229176183042h1304348H3136H2
MFCD00304420
N~2~N~2~N~4~N~4~N~6~N~6~hexabenzyl1352lambda~5~4lambda~5~6lambda~5~triazatriphosphinine224466hexamine
ZINC000150416161
ZINC150416161

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.