Diethyl P-[(2-cyanophenyl)methyl]phosphonate

CAS Registry Number®

23973-65-1
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CAS Name

Diethyl P-[(2-cyanophenyl)methyl]phosphonate

Molecular Formula

C12H16NO3P

Molecular Mass

253.23

Cite this Page

Diethyl P-[(2-cyanophenyl)methyl]phosphonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23973-65-1 (retrieved 2024-09-09) (CAS RN: 23973-65-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    146-148 °C @ Press: 0.1 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16NO3P/c1-3-15-17(14,16-4-2)10-12-8-6-5-7-11(12)9-13/h5-8H,3-4,10H2,1-2H3

InChIKey

InChIKey=YDFXKRLGZYFXOE-UHFFFAOYSA-N

SMILES

C(P(OCC)(OCC)=O)C1=C(C#N)C=CC=C1

Canonical SMILES

N#CC=1C=CC=CC1CP(=O)(OCC)OCC

Other Names for this Substance

  • Phosphonic acid, P-[(2-cyanophenyl)methyl]-, diethyl ester
  • Phosphonic acid, [(2-cyanophenyl)methyl]-, diethyl ester
  • Phosphonic acid, (o-cyanobenzyl)-, diethyl ester
  • Diethyl P-[(2-cyanophenyl)methyl]phosphonate
  • Diethyl (2-cyanobenzyl)phosphonate