Basic information
- CAS
78757-81-0- Standard SMILES
CCC1CCc2c(O)cccc2C1=O- InChIKey
XBEXXKGEVYNVED-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- 2-Ethyl-5-hydroxy-tetralin-1-one
- IUPAC
- 2-ethyl-5-hydroxy-3,4-dihydro-2H-naphthalen-1-one
Names & synonyms
78757-81-02-ethyl-5-hydroxy-tetralin-1-oneDTXSID206483072-ethyl-5-hydroxy-3,4-dihydro-1(2H)-naphthalenone2-Ethyl-5-hydroxy-3,4-dihydronaphthalen-1(2H)-one
Database identifiers
- CAS
78757-81-0- PubChem CID
- 24977005
- DTXSID
DTXSID20648307
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 224
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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