O-Ethyl O-(4-nitrophenyl) phenylphosphonothioate

CAS Registry Number®

2104-64-5

CAS Name

O-Ethyl O-(4-nitrophenyl) phenylphosphonothioate

Molecular Formula

C14H14NO4PS

Molecular Mass

323.30

Cite this Page

O-Ethyl O-(4-nitrophenyl) phenylphosphonothioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2104-64-5 (retrieved 2024-11-21) (CAS RN: 2104-64-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    215 °C @ Press: 5 Torr

  • Melting Point (1)

    36 °C

  • Density (1)

    1.270 g/cm³ @ Temp: 25 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C14H14NO4PS/c1-2-18-20(21,14-6-4-3-5-7-14)19-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3

InChIKey

InChIKey=AIGRXSNSLVJMEA-UHFFFAOYSA-N

SMILES

P(OC1=CC=C(N(=O)=O)C=C1)(OCC)(=S)C2=CC=CC=C2

Canonical SMILES

O=N(=O)C1=CC=C(OP(=S)(OCC)C=2C=CC=CC2)C=C1

Other Names for this Substance

  • Phosphonothioic acid, P-phenyl-, O-ethyl O-(4-nitrophenyl) ester
  • Phosphonothioic acid, phenyl-, O-ethyl O-(p-nitrophenyl) ester
  • Phosphonothioic acid, phenyl-, O-ethyl O-(4-nitrophenyl) ester
  • Phosphonothioic acid, phenyl-, ethyl p-nitrophenyl ester
  • EPN 300

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Deleted or Replaced CAS Registry Numbers

65580-81-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration