Methscopolamine bromide

• Catalog Number: ACM155419
• Product Name: Methscopolamine bromide
• CAS: 155-41-9
• Category: Heterocyclic Organic Compound
• Synonyms: Hyoscine methyl bromide
• Molecular Weight: 398.3
• Molecular Formula: C₁₈H₂₄BrNO₄
• InChI: InChI=1S/C18H24NO4.BrH/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;/h3-7,12-17,20H,8-10H2,1-2H3;1H/q+1;/p-1/t12,13-,14-,15+,16-,17+;/m1./s1
• InChI Key: CXYRUNPLKGGUJF-OZVSTBQFSA-M
• Melting Point: 214-217 °C
• Appearance: powder
• Complexity: 454
• Covalently-Bonded Unit Count: 2
• Defined Atom Stereocenter Count: 5
• Exact Mass: 397.08887
• Hazard Statements: T,N,Xn
• Heavy Atom Count: 24
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Isomeric SMILES: C[N+]1([C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.[Br-]
• Monoisotopic Mass: 397.08887
• Physical State: Powder
• Rotatable Bond Count: 5
• Safety Description: 36/37/39-45-61-60-36/37
• Supplemental Hazard Statements: H312+H332-H400
• Symbol: GHS07,GHS09
• Topological Polar Surface Area: 59.1 Ų

Custom Q&A

What is the PubChem CID number for Methscopolamine bromide?

The PubChem CID number for Methscopolamine bromide is 5459110.

What is the molecular formula of Methscopolamine bromide?

The molecular formula of Methscopolamine bromide is C18H24BrNO4.

What is the molecular weight of Methscopolamine bromide?

The molecular weight of Methscopolamine bromide is 398.3 g/mol.

What is Methscopolamine bromide functionally related to?

Methscopolamine bromide is functionally related to scopolamine.

What are the synonyms for Methscopolamine bromide?

The synonyms for Methscopolamine bromide include METHSCOPOLAMINE BROMIDE, scopolamine methyl bromide, Hyoscine methyl bromide, and Scopolamine methobromide.

What is the IUPAC name of Methscopolamine bromide?

The IUPAC name of Methscopolamine bromide is [(1S,2S,4R,5R)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl](2S)-3-hydroxy-2-phenylpropanoate;bromide.

What is the InChIKey of Methscopolamine bromide?

The InChIKey of Methscopolamine bromide is CXYRUNPLKGGUJF-OZVSTBQFSA-M.

What is the CAS number of Methscopolamine bromide?

The CAS number of Methscopolamine bromide is 155-41-9.

What is the ChEMBL ID for Methscopolamine bromide?

The ChEMBL ID for Methscopolamine bromide is CHEMBL1354199.

What is the Wikipedia page for Methscopolamine bromide?

The Wikipedia page for Methscopolamine bromide is Methylscopolamine_bromide.