Basic information
- CAS
3225-97-6- Standard SMILES
Cc1cc(Cl)c2c(c1N)C(=O)c1ccccc1C2=O- InChIKey
XHWWVXZEALFXQA-UHFFFAOYSA-N- Molecular formula
- C15H10ClNO2
- Average molar mass
- 271.7 g/mol
- Monoisotopic mass
- 271.0400063
Names & identifiers
- Preferred name
- 1-Amino-4-chloro-2-methylanthraquinone
- IUPAC
- 1-amino-4-chloro-2-methylanthracene-9,10-dione
- English name
- 1-amino-4-chloro-2-methylanthraquinone
- Molecular formula
- C15H10ClNO2
- Molecular weight
- 271.7
Names & synonyms
3225-97-61-Amino-4-chloro-2-methylanthraquinone1-amino-4-chloro-2-methylanthracene-9,10-dioneCHEMBL4089401NSC-82289NSC82289EINECS 221-755-4AW9FQB8XRR1-amino-4-chloro-2-methylanthra-9,10-quinone9,10-Anthracenedione, 1-amino-4-chloro-2-methyl-SCHEMBL35814531-AMINO-4-CHLORO-2-METHYL-9,10-ANTHRACENEDIONE
Show more names
1-amino-2-methyl-4-chloroanthraquinone1-amino-4-chloro-2-methyl-9,10-anthraquinone1-azanyl-4-chloro-2-methyl-anthracene-9,10-dione
DTXSID90186004XHWWVXZEALFXQA-UHFFFAOYSA-N9, 1-amino-4-chloro-2-methyl-BDBM50252424NSC 822891-Amino-2-methyl-4-chloranthrachinonNS00029244AE-641/00127032
Database identifiers
- CAS
3225-97-6- PubChem CID
- 18593
- DTXSID
DTXSID90186004- ChEMBL
CHEMBL4089401- UNII
- AW9FQB8XRR
- EC Number
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 411
Physicochemical properties
- Melting point
- 265 · 265-266 °C
- Boiling point
- 508.7 · 508.7±50.0 °C(Predicted)
- Density
- 1.433 · 1.433±0.06 g/cm3(Predicted)
- pka
- -1.11 · -1.11±0.20(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers7 total
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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