Basic information
- CAS
6448-90-4- Standard SMILES
COc1cccc2c1C(=O)c1cccc(OC)c1C2=O- InChIKey
PEUAYWBFWSCPHA-UHFFFAOYSA-N- Molecular formula
- C16H12O4
- Average molar mass
- 268.26 g/mol
- Monoisotopic mass
- 268.07355886
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,5-dimethoxy-
- IUPAC
- 1,5-dimethoxyanthracene-9,10-dione
- English name
- 1,5-dimethoxyanthraquinone
- Molecular formula
- C16H12O4
- Molecular weight
- 268.26
Names & synonyms
1,5-Dimethoxyanthrachinon9,10-Anthracenedione, 1,5-dimethoxy-1,5-Dimethoxyanthrachinon [Czech]ANTHRAQUINONE, 1,5-DIMETHOXY-EINECS 229-244-8NSC 37606BRN 1914893DTXSID70643644-08-00-03269 (Beilstein Handbook Reference)RefChem:548590DTXCID50443161,5-Dimethoxyanthraquinone
Show more names
Wln: L C666 bv ivj do1 ko1
1,5-dimethoxyanthracene-9,10-dione6448-90-49, 1,5-dimethoxy-Anthraquinone,5-dimethoxy-SCHEMBL3417492NSC37606NSC-37606STK238450
Database identifiers
- CAS
6448-90-4- PubChem CID
- 22952
- DTXSID
DTXSID7064364- EC Number
- 229-244-8
- Nikkaji
- J55.390E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 367
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 236 °C · 236°C
- Boiling point
- 371.43 °C · 371.43°C (rough estimate)
- Density
- 1.239 · 1.2390 (rough estimate)
- refractive index
- 1.5447 · 1.5447 (estimate)
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,5-dimethoxy- (6448-90-4)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
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, 1,5-dimethoxy-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers11 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
上海凌凯科技股份有限公司021-58950110 13124863828 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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