1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride
Basic information
- CAS
5263-79-6- Standard SMILES
COc1c2c(cc3cc[nH+]cc13)OCO2.[Cl-]- InChIKey
WSFKUKQTVZAWSS-UHFFFAOYSA-N- Molecular formula
- C11H10ClNO3
- Average molar mass
- 239.65 g/mol
- Monoisotopic mass
- 239.0349209
Names & identifiers
- Preferred name
- 1,3-Dioxolo(4,5-g)isoquinoline, 4-methoxy-, hydrochloride
- IUPAC
- 4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
Names & synonyms
4-Methoxy-1,3-dioxolo(4,5-g)isoquinoline hydrochloride5263-79-61,3-DIOXOLO(4,5-g)ISOQUINOLINE, 4-METHOXY-, HYDROCHLORIDERefChem:219015
Database identifiers
- CAS
5263-79-6- PubChem CID
- 21335
Properties
Computed structural properties
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
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Compound notes
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