Basic information
- CAS
53193-63-8- Standard SMILES
CCCCCCCCCCCCCCCCCCCSC1=C(O)c2ncccc2C(=O)C1=O- InChIKey
QEEUXGABIRIFBL-UHFFFAOYSA-N- Molecular formula
- C28H43NO3S
- Average molar mass
- 473.7 g/mol
- Monoisotopic mass
- 473.29636541
Names & identifiers
- Preferred name
- 6-Hydroxy-7-nonadecylmercapto-5,8-quinolindione
- IUPAC
- 8-hydroxy-7-nonadecylsulfanylquinoline-5,6-dione
- English name
- 6-Hydroxy-7-nonadecylmercapto-5,8-quinolindione
- Molecular formula
- C28H43NO3S
- Molecular weight
- 473.71
Names & synonyms
6-Hydroxy-7-nonadecylmercapto-5,8-quinolindione53193-63-8DTXSID60336877RefChem:308580DTXCID50287965QAQMRRQGGSCABE-UHFFFAOYSA-N6-Hydroxy-7-(nonadecylthio)quinoline-5,8-dione8-hydroxy-7-(nonadecylsulfanyl)quinoline-5,6-dione6-Hydroxy-7-(nonadecylsulfanyl)-5,8-quinolinedione #5,8-Quinolinedione, 6-hydroxy-7-(nonadecylthio)-
Database identifiers
- CAS
53193-63-8- PubChem CID
- 536998
- DTXSID
DTXSID60336877
Properties
Computed structural properties
- XLogP
- 9.9
- Topological polar surface area
- 92.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 19
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 604
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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