Basic information
- CAS
1519-36-4- Standard SMILES
Cc1ccc(C)c2c1C(=O)c1ccccc1C2=O- InChIKey
DVFAVJDEPNXAME-UHFFFAOYSA-N- Molecular formula
- C16H12O2
- Average molar mass
- 236.26 g/mol
- Monoisotopic mass
- 236.08372962
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,4-dimethyl-
- IUPAC
- 1,4-dimethylanthracene-9,10-dione
- English name
- 1,4-Dimethylanthraquinone
- Molecular formula
- C16H12O2
- Molecular weight
- 236.27
Names & synonyms
1,4-Dimethylanthraquinone1519-36-49,10-Anthracenedione, 1,4-dimethyl-DTXSID9061750RefChem:548564DTXCID6034920103-139-61,4-dimethylanthracene-9,10-dione9,10-Anthracenedione,1,4-dimethyl-MFCD000191691,4-dimethyl-anthraquinoneSCHEMBL55743
Show more names
TIMTEC-BB SBB008145Mitoxantrone Impurity 9DIMETHYLANTHRAQUINONE,1,4-DIMETHYLANTHRAQUINONE,1,4-(RG)1,4-dimethyl-10-anthracenedione1,4-Dimethyl-9,10-anthraquinone1,4-Dimethyl-9,10-anthracenedione
SCHEMBL30886455BAA51936CCG-56290SBB0081451,4-Dimethylanthra-9,10-quinone #AKOS015842418SY574045DB-080962
Database identifiers
- CAS
1519-36-4- PubChem CID
- 73698
- DTXSID
DTXSID9061750- EC Number
- 103-139-6
- Nikkaji
- J421.575C
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 337
Physicochemical properties
- Melting point
- 133 · 133-135 °C
- Boiling point
- 338.73 °C · 338.73°C (rough estimate)
- Density
- 1.1223 · 1.1223 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
- LogP
- 4.3 · 4.300 (est)
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,4-dimethyl- (1519-36-4)
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 24 · 24/25
- 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
Danger
H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]
P233, P260, P271, P273, P284, P304+P340, P342+P316, P391, P403, 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 CategoriesResp. Sens. 1 (100%)
Safety data
- tsca
- TSCA listed
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 24/25
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 1,4-dimethyl-: INACTIVE
Suppliers30 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
上海耐士化工科技有限公司400-188-0725 +86 21 34310725 13611771617
Related reactions
3 records
Compound notes
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