Agent Green

CAS Registry Number®

93-79-8

CAS Name

Agent Green

Molecular Formula

C12H13Cl3O3

Molecular Mass

311.59

Cite this Page

Agent Green.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93-79-8 (retrieved 2024-11-23) (CAS RN: 93-79-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    337 °C

  • Melting Point (2)

    28.5 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
  • (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C12H13Cl3O3/c1-2-3-4-17-12(16)7-18-11-6-9(14)8(13)5-10(11)15/h5-6H,2-4,7H2,1H3

InChIKey

InChIKey=FNEXNZUHBCBQTI-UHFFFAOYSA-N

SMILES

O(CC(OCCCC)=O)C1=C(Cl)C=C(Cl)C(Cl)=C1

Canonical SMILES

O=C(OCCCC)COC1=CC(Cl)=C(Cl)C=C1Cl

Other Names for this Substance

  • Acetic acid, 2-(2,4,5-trichlorophenoxy)-, butyl ester
  • Acetic acid, (2,4,5-trichlorophenoxy)-, butyl ester
  • 2,4,5-T Butyl ester
  • n-Butyl (2,4,5-trichlorophenoxy)acetate
  • Trioxone

View All

Deleted or Replaced CAS Registry Numbers

53851-79-9

CAS INSIGHTSTM
Hourglass and a clock