Basic information
- CAS
120372-85-2- Standard SMILES
CCOC(=O)c1c[nH]c2cc(OC)c(OC)cc2c1=O- InChIKey
LMEHZFXGGDLYMH-UHFFFAOYSA-N- Molecular formula
- C14H15NO5
- Average molar mass
- 277.27 g/mol
- Monoisotopic mass
- 277.09502258
Names & identifiers
- Preferred name
- 6,7-Dimethoxy-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester
- IUPAC
- ethyl 6,7-dimethoxy-4-oxo-1H-quinoline-3-carboxylate
- English name
- 6,7-DIMETHOXY-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
- Molecular formula
- C14H15NO5
- Molecular weight
- 277.27
Names & synonyms
120372-85-26,7-DIMETHOXY-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID ETHYL ESTERDTXSID50434619RefChem:306227DTXCID0038544513436-14-1ethyl 4-hydroxy-6,7-dimethoxyquinoline-3-carboxylateEthyl 6,7-dimethoxy-4-oxo-1,4-dihydroquinoline-3-carboxylateEthyl 6,7-dimethoxy-4-oxo-1H-quinoline-3-carboxylate3-Carbethoxy-4-hydroxy-6,7-dimethoxyquinolineSCHEMBL5291640SCHEMBL6202289
Show more names
3-Quinolinecarboxylic acid, 1,4-dihydro-6,7-diMethoxy-4-oxo-, ethyl ester
LMEHZFXGGDLYMH-UHFFFAOYSA-NHMS3451D064-Hydroxy-6,7-dimethoxy-quinoline-3-carboxylic acid ethyl esterAKOS000655498AKOS015966112CCG-151417SB69500CS-0337726
Database identifiers
- CAS
120372-85-2- PubChem CID
- 10039149
- DTXSID
DTXSID50434619
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 420
Physicochemical properties
- Boiling point
- 425.1 · 425.1±45.0 °C(Predicted)
- Density
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- pka
- 1.63 · 1.63±0.70(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers9 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
Shanxi Tihondan Pharmaceutical Technology Co., Ltd+8618235132063 · [email protected]
苏州键合化学试剂有限公司0512-69561983 13914027025 · [email protected]
成都麦卡希化工有限公司028-85632863 18108198598 · [email protected]
衢州爱美康生物科技有限公司0570-3081766 18357083060 · [email protected]
苏州美诺医药科技有限公司0512-69561983 13914027025 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
3 records
Compound notes
Loading…