Basic information
- CAS
24519-41-3- Standard SMILES
O=C1C2=C(SCCS2)C(=O)N1c1ccc(O)cc1- InChIKey
IDMHFACAUBBLJQ-UHFFFAOYSA-N- Molecular formula
- C12H9NO3S2
- Average molar mass
- 279.3 g/mol
- Monoisotopic mass
- 279.0023855
Names & identifiers
- Preferred name
- 5H-1,4-Dithiino(2,3-c)pyrrole-5,7(6H)-dione, 2,3-dihydro-6-(4-hydroxyphenyl)-
- IUPAC
- 6-(4-hydroxyphenyl)-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrole-5,7-dione
Names & synonyms
24519-41-3RA(sub 17)5H-1,4-DITHIINO(2,3-c)PYRROLE-5,7(6H)-DIONE, 2,3-DIHYDRO-6-(4-HYDROXYPHENYL)-BRN 0960314DTXSID50179270p-Dithiin-2,3-dicarboximide, 5,6-dihydro-N-(4-hydroxyphenyl)-2,3-Dihydro-6-(4-hydroxyphenyl)-5H-1,4-dithiino(2,3-c)pyrrole-5,7(6H)-dioneRefChem:305272DTXCID801017616-(4-hydroxyphenyl)-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrole-5,7-dione6-(4-Hydroxyphenyl)-2,3-dihydro-5H-[1,4]dithiino[2,3-c]pyrrole-5,7(6H)-dioneOprea1_381348
Show more names
SR-01000205857SR-01000205857-1
Database identifiers
- CAS
24519-41-3- PubChem CID
- 32476
- DTXSID
DTXSID50179270
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…