Basic information
- Name:
2l5,4l5,6l5-1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexaphenoxy-
- Superlist Name:
- 2,2,4,4,6,6-Hexahydro-2,2,4,4,6,6-hexaphenoxytriazatriphosphorine
- CAS No.:
1184-10-7
- Molecular Structure:
- Formula:
- C36H30N3O6P3
- Synonyms:
- 1,3,5,2,4,6-Triazatriphosphorine,2,2,4,4,6,6-hexahydro-2,2,4,4,6,6-hexaphenoxy- (7CI,8CI,9CI);Phenylmetaphosphimate, trimer (6CI);2,2,4,4,6,6-Hexahydro-2,2,4,4,6,6-hexaphenoxytriazatriphosphorine;Diphenoxyphosphazene cyclic trimer;Hexaphenoxy-1,3,5,2,4,6-triazatriphosphorine;Hexaphenoxycyclotriphosphazatriene;Hexaphenoxycyclotriphosphazene;NSC 117810;Trimeric bis(phenoxy)phosphonitrile;Phenoxycycloposphazene(CAS:1184-10-7);Phenoxycycloposphazene;
- Density:
- 1.31 g/cm3
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Specification
The 2l5,4l5,6l5-1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexaphenoxy-, with its CAS registry number 1184-10-7, has the IUPAC name of 2,2,4,4,6,6-hexaphenoxy-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene. And it has the molecular formula of C36H30N3O6P3.
The characteristics of 2l5,4l5,6l5-1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexaphenoxy- are as follows: (1)#H bond acceptors: 9; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 12; (4)Polar Surface Area: 94.05 Å2; (5)Index of Refraction: 1.637; (6)Molar Refractivity: 188.69 cm3; (7)Molar Volume: 525.4 cm3; (8)Polarizability: 74.8×10-24cm3; (9)Surface Tension: 58.2 dyne/cm; (10)Density: 1.31 g/cm3; (11)Exact Mass: 693.134745; (12)MonoIsotopic Mass: 693.134745; (13)Topological Polar Surface Area: 92.5; (14)Heavy Atom Count: 48; (15)Complexity: 912; (16)Covalently-Bonded Unit Count: 1.
The production method of this chemical is as below: Phenol could react to produce 2l5,4l5,6l5-1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexaphenoxy-, and it happens in the reagent of 50 percent NaH, (NPCl2)3 and the solvent of tetrahydrofuran and paraffin in the condition of heating for 48 hours.
What's more, the following datas could be converted into the molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)OP2(=NP(=NP(=N2)(OC3=CC=CC=C3)OC4=CC=CC=C4)(OC5=CC=CC=C5)
OC6=CC=CC=C6)OC7=CC=CC=C7
(2)InChI: InChI=1S/C36H30N3O6P3/c1-7-19-31(20-8-1)40-46(41-32-21-9-2-10-22-32)37-
47(42-33-23-11-3-12-24-33,43-34-25-13-4-14-26-34)39-48(38-46,44-35-27-15-5-16-28-35)45-36-29-17-6-18-30-36/h1-30H
(3)InChIKey: RNFJDJUURJAICM-UHFFFAOYSA-N
