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Reference substances

Reference substances

Currently viewing:
IUPAC name:
O,O,O-tris-(4-isocyanatophenyl) thiophosphate

Inventory

EC number:
223-981-9
EC name:
Tris(p-isocyanatophenyl) thiophosphate
CAS number:
4151-51-3
CAS number:
4151-51-3
Synonyms
Names:
Isocyanic acid, p-hydroxyphenyl ester, phosphorothioate (3:1) (ester)
Phenol, 4-isocyanato-, phosphorothioate (3:1) (ester)
Thionophosphoric acid-tris-(p-isocyanatophenyl ester)
Identifier:
IUPAC name
O,O,S-tris(4-isocyanatophenyl) thiophosphate
O,O,O-tris-(4-isocyanatophenyl) thiophosphate

Molecular and structural information

Molecular formula:
C21H12N3O6PS
Molecular weight:
465.38
SMILES notation:
O=C=Nc1ccc(OP(=O)(Oc2ccc(cc2)N=C=O)Sc3ccc(cc3)N=C=O)cc1
InChl:
InChI=1/C21H12N3O6PS/c25-13-22-16-1-7-19(8-2-16)29-31(28,30-20-9-3-17(4-10-20)23-14-26)32-21-11-5-18(6-12-21)24-15-27/h1-12H
Structural formula:
Chemical structure

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