2-Methyl-5-quinolinecarboxylic acid
Basic information
- CAS
634-39-9- Standard SMILES
Cc1ccc2c(C(=O)O)cccc2n1- InChIKey
VKJCKNYCWUGWEW-UHFFFAOYSA-N- Molecular formula
- C11H9NO2
- Average molar mass
- 187.19 g/mol
- Monoisotopic mass
- 187.06332853
Names & identifiers
- Preferred name
- 2-Methyl-5-quinolinecarboxylic acid
- IUPAC
- 2-methylquinoline-5-carboxylic acid
- English name
- 5-Quinolinecarboxylicacid,2-methyl-(8CI,9CI)
- Molecular formula
- C11H9NO2
- Molecular weight
- 187.19
Names & synonyms
634-39-92-Methyl-5-quinolinecarboxylic acidDTXSID40313060RefChem:263572DTXCID402641842-methylquinoline-5-carboxylic acidMFCD073664995-Quinolinecarboxylicacid, 2-methyl-NSC266128CHEMBL242110SCHEMBL2289118SCHEMBL30048398
Show more names
Quinaldine-5-carboxylic acid5-Quinolinecarboxylicacid,2-methyl-5-Quinolinecarboxylicacid,2-methyl-(8CI,9CI)
methylquinoline-5-carboxylic acid2-methylquinoline-5-carboxylicacid2-methyl-quinoline-5-carboxylic acidAKOS016028514AT21930GG-0060NSC-266128SB68347
Database identifiers
- CAS
634-39-9- PubChem CID
- 319976
- DTXSID
DTXSID40313060- ChEMBL
CHEMBL242110- Nikkaji
- J135.621F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- storage temp.
- Store at room temperature
- Appearance
- Light yellow to brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
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Related reactions
3 records
Compound notes
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