Pentolite

CAS Registry Number®

8066-33-9

CAS Name

Pentolite

Molecular Formula

C7H5N3O6.C5H8N4O12

Molecular Mass

543.27

Cite this Page

Pentolite.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=8066-33-9 (retrieved 2025-07-16) (CAS RN: 8066-33-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H5N3O6.C5H8N4O12/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16;10-6(11)18-1-5(2-19-7(12)13,3-20-8(14)15)4-21-9(16)17/h2-3H,1H3;1-4H2

InChIKey

InChIKey=HZTVIZREFBBQMG-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(C)C(N(=O)=O)=CC(N(=O)=O)=C1.C(CON(=O)=O)(CON(=O)=O)(CON(=O)=O)CON(=O)=O

Canonical SMILES

O=N(=O)OCC(CON(=O)=O)(CON(=O)=O)CON(=O)=O.O=N(=O)C=1C=C(C(=C(C1)N(=O)=O)C)N(=O)=O

Other Names for this Substance

  • 1,3-Propanediol, 2,2-bis[(nitrooxy)methyl]-, 1,3-dinitrate, mixt. with 2-methyl-1,3,5-trinitrobenzene
  • 1,3-Propanediol, 2,2-bis[(nitrooxy)methyl]-, dinitrate (ester), mixt. with 2-methyl-1,3,5-trinitrobenzene
  • Benzene, 2-methyl-1,3,5-trinitro-, mixt. contg.
  • Pentolite
  • Anzomex PowerPlus P

CAS INSIGHTSTM
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