Basic information
- CAS
51030-24-1- Standard SMILES
O=C1c2cccc(O)c2C(=O)c2c1ccc(O)c2O- InChIKey
BLUGLAWBGJZTRV-UHFFFAOYSA-N- Molecular formula
- C14H8O5
- Average molar mass
- 256.21 g/mol
- Monoisotopic mass
- 256.03717335
Names & identifiers
- Preferred name
- 1,2,8-Trihydroxyanthraquinone
- IUPAC
- 1,2,8-trihydroxyanthracene-9,10-dione
- English name
- 1,2,8-Trihydroxyanthraquinone
- Molecular formula
- C14H8O5
- Molecular weight
- 256.21
Names & synonyms
51030-24-11,2,8-trihydroxyanthracene-9,10-dione1,2,8-TRIHYDROXYANTHRAQUINONENSC386279, 1,2,8-trihydroxy-CHEMBL425365SCHEMBL6901176SCHEMBL29929513DTXSID80328592BLUGLAWBGJZTRV-UHFFFAOYSA-NNSC-38627AKOS015963956
Show more names
9,10-Anthracenedione, 1,2,8-trihydroxy-
Database identifiers
- CAS
51030-24-1- PubChem CID
- 412282
- DTXSID
DTXSID80328592- ChEMBL
CHEMBL425365- Nikkaji
- J195.799F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 94.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers1 total
Alfa Chemistry+1-5166625404 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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