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Dodecachlorocyclohexaphosphazene

HCID 76107
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Basic information

CAS
2851-52-7
Standard SMILES
ClP1(Cl)=NP(Cl)(Cl)=NP(Cl)(Cl)=NP(Cl)(Cl)=NP(Cl)(Cl)=NP(Cl)(Cl)=N1
InChIKey
KJRGXLZAQQBDNB-UHFFFAOYSA-N
Molecular formula
Cl12N6P6
Average molar mass
695.3 g/mol
Monoisotopic mass
689.487248

Names & identifiers

Preferred name
Dodecachlorocyclohexaphosphazene
IUPAC
2,2,4,4,6,6,8,8,10,10,12,12-dodecachloro-1,3,5,7,9,11-hexaza-2λ5,4λ5,6λ5,8λ5,10λ5,12λ5-hexaphosphacyclododeca-1,3,5,7,9,11-hexaene

Names & synonyms

2851-52-7Dodecachlorocyclohexaphosphazene2,2,4,4,6,6,8,8,10,10,12,12-Dodecachloro-2,2,4,4,6,6,8,8,10,10,12,12-dodecahydro-1,3,5,7,9,11-hexaaza-2,4,6,8,10,12-hexaphosphacyclododeca-1,3,5,7,9,11-hexaenePhosphonitrile chloride, cyclic hexamer-DTXSID009512001,3,5,7,9,11-Hexaaza-2,4,6,8,10,12-hexaphosphacyclododeca-1,3,5,7,9,11-hexaene, 2,2,4,4,6,6,8,8,10,10,12,12-dodecachloro-2,2,4,4,6,6,8,8,10,10,12,12-dodecahydro-2,2,4,4,6,6,8,8,10,10,12,12-Dodecachloro-2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~,10lambda~5~,12lambda~5~-cyclohexaphosphaza-1,3,5,7,9,11-hexaene

Database identifiers

CAS
2851-52-7
PubChem CID
76107
DTXSID
DTXSID00951200
Nikkaji
J1.559.253B

Properties

Computed structural properties

XLogP
10.6
Topological polar surface area
74.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
0
Heavy atoms
24
Formal charge
0
Complexity
576

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Compound notes

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