6-Ethoxy-4-hydroxyquinoline-3-carboxylic acid
Basic information
- CAS
303121-10-0- Standard SMILES
CCOc1ccc2[nH]cc(C(=O)O)c(=O)c2c1- InChIKey
FRMATZBTAXOKFT-UHFFFAOYSA-N- Molecular formula
- C12H11NO4
- Average molar mass
- 233.22 g/mol
- Monoisotopic mass
- 233.06880783
Names & identifiers
- Preferred name
- 6-Ethoxy-4-hydroxyquinoline-3-carboxylic acid
- IUPAC
- 6-ethoxy-4-oxo-1H-quinoline-3-carboxylic acid
- English name
- 6-ETHOXY-4-HYDROXY-QUINOLINE-3-CARBOXYLIC ACID
- Molecular formula
- C12H11NO4
- Molecular weight
- 233.22
Names & synonyms
6-ethoxy-4-hydroxyquinoline-3-carboxylic acid303121-10-06-Ethoxy-4-hydroxy-quinoline-3-carboxylic acid51726-50-26-ethoxy-4-oxo-1H-quinoline-3-carboxylic acid6-ethoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acidMFCD02217683Oprea1_573935SCHEMBL2010976DTXSID503494563-Quinolinecarboxylic acid, 6-ethoxy-4-hydroxy-AB11574
Show more names
AURORA 17942AKOS BBS-00008771OTAVA-BB 0109850005OTAVA-BB BB01098500056-Ethoxy-4-hydroxy-3-quinolinecarboxylic acid
CS-16314MLS000068982MFCD052284486-Ethoxy-4-hydroxyquinoline-3-carboxylicacidTimTec1_008109Oprea1_438989CHEMBL445571HMS1557A13
Database identifiers
- CAS
303121-10-0、51726-50-2- PubChem CID
- 648345
- DTXSID
DTXSID50349456- ChEMBL
CHEMBL445571
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 364
Physicochemical properties
- storage temp.
- Store at room temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2933499090 · 2933499090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933499090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
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Related reactions
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Compound notes
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