1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-
Basic information
- CAS
90832-54-5- Standard SMILES
CC1Cc2cc3c(cc2C=N1)OCO3- InChIKey
GJYMGPVIFSJHGS-UHFFFAOYSA-N- Molecular formula
- C11H11NO2
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.07897859
Names & identifiers
- Preferred name
- 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-
- IUPAC
- 7-methyl-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline
Names & synonyms
90832-54-51,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-DTXSID803285327-Methyl-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline
Database identifiers
- CAS
90832-54-5- PubChem CID
- 411451
- DTXSID
DTXSID80328532
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 30.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 254
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Compound notes
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