Basic information
- Standard SMILES
O=C1c2ccc(O)cc2C(=O)c2cc(O)ccc21- InChIKey
RZTIWMXQXBQJNE-UHFFFAOYSA-N- Molecular formula
- C14H8O4
- Average molar mass
- 240.21 g/mol
- Monoisotopic mass
- 240.04225873
Names & identifiers
- Preferred name
- 2,7-Dihydroxyanthraquinone
- IUPAC
- 2,7-dihydroxyanthracene-9,10-dione
- English name
- 2,6-Dihydroxyanthraquinone
- Molecular formula
- C14H8O4
- Molecular weight
- 240.21
Names & synonyms
572-93-02,7-Dihydroxyanthraquinone9,10-Anthracenedione, 2,7-dihydroxy-2,7-dihydroxy-9,10-anthracenedioneHF9PL7VW3GEINECS 209-343-2DTXSID5060352RefChem:445971DTXCID8042183209-343-22,7-dihydroxyanthracene-9,10-dioneisoanthraflavin
Show more names
ANTHRAFLAVIC ACID2,6-Dihydroxyanthraquinone2,6-DIHYDROXYANTHRA-9,10-QUINONE
2,7-dihydroxy-9,10-anthraquinoneIsoanthraflavic acidCHEBI:37503UNII-HF9PL7VW3G2,7-Dihydroxy-anthrachinonSCHEMBL27724762,7 DIHYDROXYANTHRAQUINONE2,7-DIHYDROXYANTHRRAQUINONE
Database identifiers
- CAS
572-93-0- PubChem CID
- 68445
- DTXSID
DTXSID5060352- ChEBI
CHEBI:37503- UNII
- HF9PL7VW3G
- EC Number
- 209-343-2
- Nikkaji
- J11.537A
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 346
Physicochemical properties
- Melting point
- 320 °C · >320 °C(lit.)
- Boiling point
- 342.92 °C · 342.92°C (rough estimate)
- Density
- 1.3032 · 1.3032 (rough estimate)
- refractive index
- 1.543 · 1.5430 (estimate)
- pka
- 6.78 · 6.78±0.20(Predicted)
- FDA UNII
- 9 PL7VW3G · HF9PL7VW3G
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 2,7-dihydroxy- (572-93-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-37/39
- WGK Germany
- 3 · 3
- RTECS
- 6675000 · CB6675000
- TSCA
- TSCA listed
Safety & regulation
Hazard information
Regulatory InformationChemical: 9,10-Anthracenedione, 2,7-dihydroxy-
Regulatory information
Regulatory InformationChemical: 9,10-Anthracenedione, 2,7-dihydroxy-
Safety data
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- CB6675000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 2,7-dihydroxy-: ACTIVE
Suppliers9 total
吉林中科研伸科技有限公司18143011203 · [email protected]
吉林中科研伸科技有限公司0431-80514535 19917294565 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
Additional notes
DefinitionChEBI: Isoanthraflavin is a dihydroxyanthraquinone.
Related reactions
2 records
Linked notes
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