5-Bromo-4-chloro-3-indolyl β-D-glucopyranoside

CAS Registry Number®

15548-60-4

CAS Name

5-Bromo-4-chloro-3-indolyl β-D-glucopyranoside

Molecular Formula

C14H15BrClNO6

Molecular Mass

408.63

Cite this Page

5-Bromo-4-chloro-3-indolyl β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=15548-60-4 (retrieved 2024-11-21) (CAS RN: 15548-60-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    235-237 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13-,14-/m1/s1

InChIKey

InChIKey=OPIFSICVWOWJMJ-LNNRFACYSA-N

SMILES

O(C=1C=2C(NC1)=CC=C(Br)C2Cl)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

Canonical SMILES

ClC1=C(Br)C=CC=2NC=C(OC3OC(CO)C(O)C(O)C3O)C12

Other Names for this Substance

  • β-D-Glucopyranoside, 5-bromo-4-chloro-1H-indol-3-yl
  • Indole, 5-bromo-4-chloro-3-(β-D-glucopyranosyloxy)-
  • 5-Bromo-4-chloro-1H-indol-3-yl β-D-glucopyranoside
  • 4-Chloro-5-bromo-3-indolyl-β-D-glucoside
  • 5-Bromo-4-chloro-3-indolyl β-D-glucoside

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Deleted or Replaced CAS Registry Numbers

98048-69-2, 136013-63-3, 329950-23-4, 878490-83-6

CAS INSIGHTSTM
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