6-Chloro-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid
Basic information
- CAS
897560-14-4- Standard SMILES
CCOc1ccccc1-c1cc(C(=O)O)c2cc(Cl)ccc2n1- InChIKey
WXUKMVSZQUJNKK-UHFFFAOYSA-N- Molecular formula
- C18H14ClNO3
- Average molar mass
- 327.8 g/mol
- Monoisotopic mass
- 327.066221
Names & identifiers
- Preferred name
- 6-Chloro-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid
- IUPAC
- 6-chloro-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid
- English name
- 6-CHLORO-2-(2-ETHOXYPHENYL)QUINOLINE-4-CARBOXYLICACID
- Molecular formula
- C18H14ClNO3
- Molecular weight
- 327.76
Names & synonyms
6-chloro-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid897560-14-4MFCD034201186-CHLORO-2-(2-ETHOXYPHENYL)QUINOLINE-4-CARBOXYLICACIDDTXSID201208279ALBB-000612BBL037467STK502295AKOS005170977SB72283VS-14182H20999
Show more names
6-chloro-2-(2-ethoxyphenyl)cinchoninic acid4-Quinolinecarboxylic acid, 6-chloro-2-(2-ethoxyphenyl)-
6-Chloro-2-(2-ethoxyphenyl)-4-quinolinecarboxylic acid
Database identifiers
- CAS
897560-14-4- PubChem CID
- 5115438
- DTXSID
DTXSID201208279
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 419
Physicochemical properties
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
- hazard_code
- Xi
- hazard_class
- IRRITANT
Suppliers
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Related reactions
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Compound notes
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