Basic information
- CAS
147269-07-6- Standard SMILES
COc1ccc(-c2ccc(C(=O)O)c(=O)[nH]2)cc1- InChIKey
FQXDUENLSLFAOZ-UHFFFAOYSA-N- Molecular formula
- C13H11NO4
- Average molar mass
- 245.23 g/mol
- Monoisotopic mass
- 245.06880783
Names & identifiers
- Preferred name
- 6-(4-Methoxyphenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
- IUPAC
- 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
- English name
- 6-(4-METHOXY-PHENYL)-2-OXO-1,2-DIHYDRO-PYRIDINE-3-CARBOXYLIC ACID
- Molecular formula
- C13H11NO4
- Molecular weight
- 245.23
Names & synonyms
147269-07-66-(4-methoxyphenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acidDTXSID40377647RefChem:306655DTXCID003286756-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid6-(4-Methoxy-phenyl)-2-oxo-1,2-dihydro-pyridine-3-carboxylic acidMFCD029264056-(4-methoxyphenyl)-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid3-Pyridinecarboxylic acid, 1,2-dihydro-6-(4-methoxyphenyl)-2-oxo-2-Hydroxy-6-(4-methoxyphenyl)nicotinic acid6-(4-methoxyphenyl)-2-oxohydropyridine-3-carboxylic acid
Show more names
ST5210429SMR000278223BAS 05515866CHEMBRDG-BB 4400284ASINEX-REAG BAS 055158662-keto-6-(4-methoxyphenyl)-1H-pyridine-3-carboxylic acid
MLS000716706SCHEMBL7116716CHEMBL1502516HMS1699K06HMS2656G21ALBB-017390SBB028118STK636415
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 417
Experimental & physicochemical properties
Solubility>36.8 [ug/mL] (The mean of the results at pH 7.4)
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
Chemistry & industry
Suppliers2 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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