Basic information
- CAS
27827-70-9- Standard SMILES
CC1=NCC(O)COc2c1ccc1ccccc21- InChIKey
RTLHJYAAONADNA-UHFFFAOYSA-N- Molecular formula
- C15H15NO2
- Average molar mass
- 241.28 g/mol
- Monoisotopic mass
- 241.11027872
Names & identifiers
- Preferred name
- 6-Methyl-3,4-dihydro-2H-naphth(1,2-b)-1,5-oxazocin-3-ol
- IUPAC
- 11-methyl-16-oxa-12-azatricyclo[8.6.0.02,7]hexadeca-1(10),2,4,6,8,11-hexaen-14-ol
Names & synonyms
6-Methyl-3,4-dihydro-2H-naphth(1,2-b)-1,5-oxazocin-3-ol27827-70-9BRN 49155602H-NAPHTH(1,2-b)-1,5-OXAZOCIN-3-OL, 3,4-DIHYDRO-6-METHYL-
Database identifiers
- CAS
27827-70-9- PubChem CID
- 34035
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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