(3,4,5-Trimethoxyphenyl)acetonitrile

CAS Registry Number®

13338-63-1
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CAS Name

(3,4,5-Trimethoxyphenyl)acetonitrile

Molecular Formula

C11H13NO3

Molecular Mass

207.23

Cite this Page

(3,4,5-Trimethoxyphenyl)acetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=13338-63-1 (retrieved 2024-04-20) (CAS RN: 13338-63-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    77 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H13NO3/c1-13-9-6-8(4-5-12)7-10(14-2)11(9)15-3/h6-7H,4H2,1-3H3

InChIKey

InChIKey=ACFJNTXCEQCDBX-UHFFFAOYSA-N

SMILES

O(C)C1=C(OC)C=C(CC#N)C=C1OC

Canonical SMILES

N#CCC1=CC(OC)=C(OC)C(OC)=C1

Other Names for this Substance

  • Benzeneacetonitrile, 3,4,5-trimethoxy-
  • Acetonitrile, (3,4,5-trimethoxyphenyl)-
  • 3,4,5-Trimethoxybenzeneacetonitrile
  • 3,4,5-Trimethoxybenzylnitrile
  • (3,4,5-Trimethoxyphenyl)acetonitrile

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