Basic information
- CAS
15599-22-1- Standard SMILES
CC[N+]1(C)CCC(OC(=O)C(c2ccccc2)C2CCCC2)C1.[Br-]- InChIKey
HZVNJIOPUIMLRO-UHFFFAOYSA-M- Molecular formula
- C20H30BrNO2
- Average molar mass
- 396.4 g/mol
- Monoisotopic mass
- 395.14599
Names & identifiers
- Preferred name
- Cyclopyrronium Bromide
- IUPAC
- (1-ethyl-1-methylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-phenylacetate bromide
- English name
- Cyclopyrronium
- Molecular weight
- 0
Names & synonyms
Cyclopyrronium Bromide15599-22-1Cyclopyrronium bromide [INN]Bromuro de ciclopirronioBromure de cyclopyrroniumAHR 354Cyclopyrronii bromidumCyclopyrronii bromidum [INN-Latin]UNII-8C19ZXR2J2Bromure de cyclopyrronium [INN-French]Bromuro de ciclopirronio [INN-Spanish]8C19ZXR2J2
Show more names
Cyclopyrronium
1-Ethyl-3-hydroxy-1-methylpyrrolidinium bromide alpha-cyclopentylphenylacetate1-Ethyl-3-hydroxy-1-methylpyrrolidinium bromide alpha-phenylcyclopentaneacetatePyrrolidinium, 1-ethyl-3-hydroxy-1-methyl-, bromide, cyclopentylphenylacetatePyrrolidinium, 3-((cyclopentylphenylacetyl)oxy)-1-ethyl-1-methyl-, bromidePyrrolidinium, 1-ethyl-3-hydroxy-1-methyl-, bromide, alpha-phenylcyclopentaneacetateCyclopyrronii bromidum (INN-Latin)1-ETHYL-3-HYDROXY-1-METHYLPYRROLIDINIUM BROMIDE .ALPHA.-CYCLOPENTYLPHENYLACETATEBromure de cyclopyrronium (INN-French)
Database identifiers
- CAS
15599-22-1- PubChem CID
- 72082
- DTXSID
DTXSID70935335- ChEMBL
CHEMBL2106017- UNII
- 8C19ZXR2J2
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- FDA UNII
- 8 C19ZXR2J2 · 8C19ZXR2J2
Chemistry & industry
Suppliers2 total
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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