5-[2-[6-[2-(Dimethylamino)ethyl]-1,3-benzodioxol-5-yl]acetyl]-1,3-benzodioxole-4-carboxylic acid

CAS Registry Number®

51059-65-5

CAS Name

5-[2-[6-[2-(Dimethylamino)ethyl]-1,3-benzodioxol-5-yl]acetyl]-1,3-benzodioxole-4-carboxylic acid

Molecular Formula

C21H21NO7

Molecular Mass

399.39

Cite this Page

5-[2-[6-[2-(Dimethylamino)ethyl]-1,3-benzodioxol-5-yl]acetyl]-1,3-benzodioxole-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51059-65-5 (retrieved 2024-11-08) (CAS RN: 51059-65-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    250 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H21NO7/c1-22(2)6-5-12-8-17-18(28-10-27-17)9-13(12)7-15(23)14-3-4-16-20(29-11-26-16)19(14)21(24)25/h3-4,8-9H,5-7,10-11H2,1-2H3,(H,24,25)

InChIKey

InChIKey=ZWRGIDKDYJXLHP-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C2C(=CC=C1C(CC3=C(CCN(C)C)C=C4C(=C3)OCO4)=O)OCO2

Canonical SMILES

O=C(O)C1=C2OCOC2=CC=C1C(=O)CC3=CC=4OCOC4C=C3CCN(C)C

Other Names for this Substance

  • 1,3-Benzodioxole-4-carboxylic acid, 5-[2-[6-[2-(dimethylamino)ethyl]-1,3-benzodioxol-5-yl]acetyl]-
  • 1,3-Benzodioxole-4-carboxylic acid, 5-[[6-[2-(dimethylamino)ethyl]-1,3-benzodioxol-5-yl]acetyl]-
  • 5-[2-[6-[2-(Dimethylamino)ethyl]-1,3-benzodioxol-5-yl]acetyl]-1,3-benzodioxole-4-carboxylic acid
  • Adlumidiceine

CAS INSIGHTSTM
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