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Bisacodyl

CAS Registry Number®

603-50-9

CAS Name

Bisacodyl

Molecular Formula

C22H19NO4

Molecular Mass

361.39

Cite this Page

Bisacodyl.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=603-50-9 (retrieved 2024-11-23) (CAS RN: 603-50-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138 °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/C22H19NO4/c1-15(24)26-19-10-6-17(7-11-19)22(21-5-3-4-14-23-21)18-8-12-20(13-9-18)27-16(2)25/h3-14,22H,1-2H3

InChIKey

InChIKey=KHOITXIGCFIULA-UHFFFAOYSA-N

SMILES

C(C1=CC=C(OC(C)=O)C=C1)(C2=CC=C(OC(C)=O)C=C2)C3=CC=CC=N3

Canonical SMILES

O=C(OC1=CC=C(C=C1)C(C2=NC=CC=C2)C3=CC=C(OC(=O)C)C=C3)C

Other Names for this Substance

  • Phenol, 4,4′-(2-pyridinylmethylene)bis-, 1,1′-diacetate
  • Phenol, 4,4′-(2-pyridylmethylene)di-, diacetate (ester)
  • Phenol, 4,4′-(2-pyridinylmethylene)bis-, diacetate (ester)
  • Phenol, 4,4′-(2-pyridylmethylene)di-, diacetate
  • Bis(p-acetoxyphenyl)-2-pyridylmethane

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