6,7-Dimethyl-5,6,7,8-tetrahydro-2H-[1,3]dioxolo[4,5-g]isoquinoline
Basic information
- CAS
6268-87-7- Standard SMILES
CC1Cc2cc3c(cc2CN1C)OCO3- InChIKey
ZLXWXQYVDYZSGF-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
- Monoisotopic mass
- 205.11027872
Names & identifiers
- Preferred name
- 6,7-Dimethyl-5,6,7,8-tetrahydro-2H-[1,3]dioxolo[4,5-g]isoquinoline
- IUPAC
- 6,7-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline
Names & synonyms
6268-87-7NSC34654DTXSID50283982NSC-34654NSC7888286,7-Dimethyl-5,6,7,8-tetrahydro-2H-[1,3]dioxolo[4,5-g]isoquinolineNSC-788828854254-97-0
Database identifiers
- CAS
6268-87-7、854254-97-0- PubChem CID
- 234564
- DTXSID
DTXSID50283982
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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