Basic information
- CAS
85842-65-5- Standard SMILES
CCOC(=O)CSc1c2ccccc2nc2ccccc12- InChIKey
QWZRGYOGNKBHDD-UHFFFAOYSA-N- Molecular formula
- C17H15NO2S
- Average molar mass
- 297.4 g/mol
- Monoisotopic mass
- 297.08234989
Names & identifiers
- Preferred name
- Ethyl [(acridin-9-yl)sulfanyl]acetate
- IUPAC
- ethyl 2-acridin-9-ylsulfanylacetate
Names & synonyms
85842-65-5Ethyl [(acridin-9-yl)sulfanyl]acetateDTXSID90511195
Database identifiers
- CAS
85842-65-5- PubChem CID
- 12840952
- DTXSID
DTXSID90511195
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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