Ilmetropium iodide

Base Information

• Chemical Name: Ilmetropium iodide
• CAS No.: 129109-88-2
• Deprecated CAS: 130404-00-1
• Molecular Formula: C20H30 N O3 . I
• Molecular Weight: 459.3616
• UNII: DK37Q6P754
• NCI Thesaurus Code: C170055
• Wikidata: Q27276433

Synonyms:hydroxymethylphenylbutyric acid iodomethylate tropine ester;troventol

Chemical Property of Ilmetropium iodide

Chemical Property:

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 459.12704
• Heavy Atom Count: 25
• Complexity: 442

Purity/Quality:

98%min ^*data from raw suppliers

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CO)(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)[N+]3(C)C.[I-]
• Isomeric SMILES: CCC(CO)(C1=CC=CC=C1)C(=O)OC2C[C@H]3CC[C@@H](C2)[N+]3(C)C.[I-]

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