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Hexa(4-methoxyphenoxy)cyclotriphosphazene

HCID 249886
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Basic information

CAS
1184-42-5
Standard SMILES
COc1ccc(OP2(Oc3ccc(OC)cc3)=NP(Oc3ccc(OC)cc3)(Oc3ccc(OC)cc3)=NP(Oc3ccc(OC)cc3)(Oc3ccc(OC)cc3)=N2)cc1
InChIKey
BGXKNHUNRNBADR-UHFFFAOYSA-N
Molecular formula
C42H42N3O12P3
Average molar mass
873.7 g/mol
Monoisotopic mass
873.19813478

Names & identifiers

Preferred name
Hexa(4-methoxyphenoxy)cyclotriphosphazene
IUPAC
2,2,4,4,6,6-hexakis(4-methoxyphenoxy)-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene

Names & synonyms

1184-42-5NSC68661SCHEMBL24529992DTXSID40290448BGXKNHUNRNBADR-UHFFFAOYSA-NNSC-68661hexa(4-methoxyphenoxy)cyclotriphosphazene2,2,4,4,6,6-Hexakis(4-methoxyphenoxy)cyclotriphosphazene2,2,4,4,6,6-Hexakis(4-methoxyphenoxy)-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine

Database identifiers

CAS
1184-42-5
PubChem CID
249886
DTXSID
DTXSID40290448
Nikkaji
J1.412.339C

Properties

Computed structural properties

XLogP
11.6
Topological polar surface area
148 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
15
Rotatable bonds
18
Heavy atoms
60
Formal charge
0
Complexity
1,160

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Compound notes

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