1,3-Dioxolo(4,5-g)isoquinolinium, 4-methoxy-6-propyl-, bromide
Basic information
- CAS
15288-33-2- Standard SMILES
CCC[n+]1ccc2cc3c(c(OC)c2c1)OCO3.[Br-]- InChIKey
GGACMNRUGZMDSV-UHFFFAOYSA-M- Molecular formula
- C14H16BrNO3
- Average molar mass
- 326.19 g/mol
- Monoisotopic mass
- 325.03136
Names & identifiers
- Preferred name
- 1,3-Dioxolo(4,5-g)isoquinolinium, 4-methoxy-6-propyl-, bromide
- IUPAC
- 4-methoxy-6-propyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide
Names & synonyms
4-Methoxy-6-propyl-1,3-dioxolo(4,5-g)isoquinolinium bromide15288-33-21,3-DIOXOLO(4,5-g)ISOQUINOLINIUM, 4-METHOXY-6-PROPYL-, BROMIDERefChem:219045DTXSID50934624Methyl(6-propyl-2H-[1,3]dioxolo[4,5-g]isoquinolin-4(6H)-ylidene)oxidanium bromide
Database identifiers
- CAS
15288-33-2- PubChem CID
- 27185
- DTXSID
DTXSID50934624
Properties
Computed structural properties
- Topological polar surface area
- 31.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 286
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…