Product Name

  • Name

    Cimetropium bromide

  • EINECS 641-412-6
  • CAS No. 51598-60-8
  • Density
  • Solubility
  • Melting Point 174°
  • Formula C21H28BrNO4
  • Boiling Point
  • Molecular Weight 438.362
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 51598-60-8 (Cimetropium bromide)
  • Hazard Symbols
  • Synonyms 3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane,9-(cyclopropylmethyl)-7-(3-hydroxy-1-oxo-2-phenylpropoxy)-9-methyl-, bromide,[7(S)-(1a,2b,4b,5a,7b)]-;3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane,9-(cyclopropylmethyl)-7-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-9-methyl-, bromide,(1a,2b,4b,5a,7b)- (9CI);Alginor;
  • PSA 59.06000
  • LogP -1.19430

Cimetropium bromide Chemical Properties

Molecule structure of Cimetropium bromide (CAS NO.51598-60-8):

Molecular Weight: 438.35532 g/mol
Molecular Formula: C21H28BrNO4
H-Bond Donor: 1
H-Bond Acceptor: 5
Rotatable Bond Count: 7
Exact Mass: 437.120171
MonoIsotopic Mass: 437.120171
Topological Polar Surface Area: 59.1
Heavy Atom Count: 27 
Canonical SMILES: C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)CC5CC5.[Br-]
InChIKey: WDURTRGFUGAJHA-PVWAJAEQSA-M
Classification Code: Autonomic Agents; Parasympatholytics; Peripheral Nervous System Agents

Cimetropium bromide Uses

 Cimetropium bromide (CAS NO.51598-60-8) is used for gallstone colic, renal colic, gastrointestinal spasm pain, biliary and urinary tract spasm pain, dysmenorrhea, labor pain.

Cimetropium bromide Specification

 Cimetropium bromide (CAS NO.51598-60-8) is also named as (7(S)-(1alpha,2beta,4beta,5alpha,7beta))-9-(Cyclopropylmethyl)-7-(3-hydroxy-1-oxo-2-phenylpropoxy)-9-methyl-3-oxa-9-azoniatricyclo(3.3.1.0(sup 2,4))nonane bromide ; 8-(Cyclopropylmethyl)-6beta,7beta-epoxy-3alpha-((S)-tropoyl)-1alphaH,5alphaH-tropanium bromid ; 8-(Cyclopropylmethyl)-6beta,7beta-epoxy-3alpha-hydroxy-1alphaH,5alphaH-tropanium bromide, (-)-(S)-tropate ; Alginor ; Bromure de cimetropium ; Bromure de cimetropium [French] ; Bromuro de cimetropio ; Bromuro de cimetropio [Spanish] ; Cimetropii bromidum ; Cimetropii bromidum [Latin] ; UNII-0C7M5WE60Q .

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