Basic information
- CAS
82-17-7- Standard SMILES
O=C1c2cccc(Oc3ccccc3)c2C(=O)c2c(Oc3ccccc3)cccc21- InChIKey
ADJYQFBOMQAMAI-UHFFFAOYSA-N- Molecular formula
- C26H16O4
- Average molar mass
- 392.4 g/mol
- Monoisotopic mass
- 392.10485899
Names & identifiers
- Preferred name
- 1,8-Diphenoxyanthraquinone
- IUPAC
- 1,8-diphenoxyanthracene-9,10-dione
- English name
- 1,8-diphenoxyanthraquinone
- Molecular formula
- C26H16O4
- Molecular weight
- 392.40284
Names & synonyms
1,8-Diphenoxyanthraquinone82-17-79,10-Anthracenedione, 1,8-diphenoxy-S6QJ6KXS4QEINECS 201-399-6DTXSID4058863ANTHRAQUINONE, 1,8-DIPHENOXY-1,8-DIPHENOXYANTHRA-9,10-QUINONERefChem:417916DTXCID2048240201-399-61,8-diphenoxyanthracene-9,10-dione
Show more names
1,8-Diphenoxyanthaquinone1,8-Diphenoxy-9,10-anthracenedione1,8-bis(phenoxy)-9,10-anthraquinone1,8-bis(phenoxy)anthracene-9,10-dione
Maybridge1_004161UNII-S6QJ6KXS4Q4,5-diphenoxyanthraquinone1,8-diphenoxy-anthraquinone1,8-diphenoxy-9,10-dihydroanthracene-9,10-dioneSCHEMBL10546429HMS553F051,8-BIS-PHENOXY-ANTHRAQUINONE
Database identifiers
- CAS
82-17-7- PubChem CID
- 66501
- DTXSID
DTXSID4058863- UNII
- S6QJ6KXS4Q
- EC Number
- 201-399-6
- Nikkaji
- J192.597K
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 569
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- FDA UNII
- 6 QJ6KXS4Q · S6QJ6KXS4Q
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,8-diphenoxy- (82-17-7)
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 1,8-diphenoxy-: INACTIVE
Suppliers6 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
河南伊诺凯新材料有限公司15764055027 15764055027 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
广州市震霖医药科技有限公司18102736234 · [email protected]
Related reactions
2 records
Compound notes
Loading…