1-(1,2-Dihydroacenaphthylen-5-yl)-2-(dipropylamino)propan-1-ol
Basic information
- CAS
6279-70-5- Standard SMILES
CCCN(CCC)C(C)C(O)c1ccc2c3c(cccc13)CC2- InChIKey
RXQTXHXIAGVMRZ-UHFFFAOYSA-N- Molecular formula
- C21H29NO
- Average molar mass
- 311.5 g/mol
- Monoisotopic mass
- 311.22491455
Names & identifiers
- Preferred name
- 1-(1,2-Dihydroacenaphthylen-5-yl)-2-(dipropylamino)propan-1-ol
- IUPAC
- 1-(1,2-dihydroacenaphthylen-5-yl)-2-(dipropylamino)propan-1-ol
Names & synonyms
6279-70-51-(1,2-dihydroacenaphthylen-5-yl)-2-(dipropylamino)propan-1-olNSC11406DTXSID40279152NSC-11406
Database identifiers
- CAS
6279-70-5- PubChem CID
- 223633
- DTXSID
DTXSID40279152
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 365
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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