Basic information
- CAS
7475-11-8- Standard SMILES
O=C1c2ccc(O)cc2C(=O)c2c(O)ccc(O)c21- InChIKey
FDXKFCSGFMVEEG-UHFFFAOYSA-N- Molecular formula
- C14H8O5
- Average molar mass
- 256.21 g/mol
- Monoisotopic mass
- 256.03717336
Overview
1,4,6-trihydroxyanthraquinone is a trihydroxyanthraquinone.
Names & identifiers
- Preferred name
- 1,4,6-Trihydroxyanthraquinone
- IUPAC
- 1,4,6-trihydroxyanthracene-9,10-dione
- English name
- 1,4,6-trihydroxyanthraquinone
- Molecular formula
- C14H8O5
- Molecular weight
- 256.21032
Names & synonyms
1,4,6-Trihydroxyanthraquinone1,4,6-trihydroxy-9,10-anthraquinone1,4,6-trihydroxyanthracene-9,10-dione7475-11-8K6UFE24N8ENSC-401142NSC4011421.4.6-TrioxyanthrachinonUNII-K6UFE24N8ESCHEMBL6906327CHEBI:37491DTXSID40225730
Show more names
FDXKFCSGFMVEEG-UHFFFAOYSA-NEINECS 231-276-2NSC 4011429,10-Anthracenedione, 1,4,6-trihydroxy-NS000474421,4,6-TRIHYDROXY-9,10-ANTHRACENEDIONEQ27117167
Database identifiers
- CAS
7475-11-8- PubChem CID
- 81989
- DTXSID
DTXSID40225730- ChEBI
CHEBI:37491- UNII
- K6UFE24N8E
- EC Number
- 231-276-2
- Nikkaji
- J195.807K
Properties
Computed structural properties
- XLogP
- 2.9
- 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
- FDA UNII
- 6 UFE24N8E · K6UFE24N8E
Chemistry & industry
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Additional notes
DefinitionChEBI: 1,4,6-trihydroxyanthraquinone is a trihydroxyanthraquinone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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