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Substance Name: Phenol, 3-methyl-4-nitro-, 1,1',1''-(phosphate)
RN: 68527-98-0
InChIKey: SNIKDGGXGSYRMO-UHFFFAOYSA-N

Molecular Formula

  • C21-H18-N3-O10-P

Molecular Weight

  • 503.358
 
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Names and Synonyms

Synonyms

  • EINECS 271-291-1
  • Phosphoric acid, tri(4-nitro-m-cresyl) ester

Systematic Names

  • Phenol, 3-methyl-4-nitro-, 1,1',1''-(phosphate)
  • Phenol, 3-methyl-4-nitro-, phosphate (3:1) (ester)
  • Tris(4-nitro-m-tolyl) phosphate

Registry Numbers

CAS Registry Number

  • 68527-98-0

System Generated Number

  • 0068527980

Structure Descriptors

InChI

1S/C21H18N3O10P/c1-13-10-16(4-7-19(13)22(25)26)32-35(31,33-17-5-8-20(23(27)28)14(2)11-17)34-18-6-9-21(24(29)30)15(3)12-18/h4-12H,1-3H3

InChIKey

SNIKDGGXGSYRMO-UHFFFAOYSA-N

Smiles

O=P(Oc1ccc([N+](=O)[O-])c(C)c1)(Oc1ccc([N+]([O-])=O)c(C)c1)Oc1ccc([N+]([O-])=O)c(C)c1