2-(Chloromethyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

CAS Registry Number®

50677-29-7

CAS Name

2-(Chloromethyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Molecular Formula

C12H13ClN2O4

Molecular Mass

284.70

Cite this Page

2-(Chloromethyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=50677-29-7 (retrieved 2024-11-22) (CAS RN: 50677-29-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    120-122 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H13ClN2O4/c1-16-8-4-7(5-9(17-2)11(8)18-3)12-15-14-10(6-13)19-12/h4-5H,6H2,1-3H3

InChIKey

InChIKey=MCQVCVYAUIGFJQ-UHFFFAOYSA-N

SMILES

O(C)C=1C=C(C=C(OC)C1OC)C=2OC(CCl)=NN2

Canonical SMILES

ClCC1=NN=C(O1)C=2C=C(OC)C(OC)=C(OC)C2

Other Names for this Substance

  • 1,3,4-Oxadiazole, 2-(chloromethyl)-5-(3,4,5-trimethoxyphenyl)-
  • 2-(Chloromethyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

CAS INSIGHTSTM
Hourglass and a clock