Homatropine methobromide

CAS Registry Number®

80-49-9

CAS Name

Homatropine methobromide

Molecular Formula

C17H24NO3.Br

Cite this Page

Homatropine methobromide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80-49-9 (retrieved 2024-11-21) (CAS RN: 80-49-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    191-192 °C (decomp)

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1/C17H24NO3.BrH/c1-18(2)13-8-9-14(18)11-15(10-13)21-17(20)16(19)12-6-4-3-5-7-12;/h3-7,13-16,19H,8-11H2,1-2H3;1H/q+1;/p-1/t13-,14+,15+,16?;

InChIKey

InChIKey=FUFVKLQESJNNAN-RIMUKSHENA-M

SMILES

C[N+]1(C)[C@]2(C[C@H](OC(C(O)C3=CC=CC=C3)=O)C[C@@]1(CC2)[H])[H].[Br-]

Canonical SMILES

[Br-].O=C(OC1CC2CCC(C1)[N+]2(C)C)C(O)C=3C=CC=CC3

Other Names for this Substance

  • 8-Azoniabicyclo[3.2.1]octane, 3-[(2-hydroxy-2-phenylacetyl)oxy]-8,8-dimethyl-, bromide (1:1), (3-endo)-
  • 8-Methylhomatropinium bromide
  • 1αH,5αH-Tropanium, 3α-hydroxy-8-methyl-, bromide, mandelate
  • 8-Azoniabicyclo[3.2.1]octane, 3-[(hydroxyphenylacetyl)oxy]-8,8-dimethyl-, bromide, endo-(±)-
  • 8-Azoniabicyclo[3.2.1]octane, 3-[(hydroxyphenylacetyl)oxy]-8,8-dimethyl-, bromide, (3-endo)-

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Deleted or Replaced CAS Registry Numbers

42522-67-8, 55198-66-8, 58725-74-9, 1786394-41-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration