6-Iodo-2-methylquinoline-4-carboxylic acid
Basic information
- CAS
433244-12-3- Standard SMILES
Cc1cc(C(=O)O)c2cc(I)ccc2n1- InChIKey
GBYQKIVJBNZXTF-UHFFFAOYSA-N- Molecular formula
- C11H8INO2
- Average molar mass
- 313.09 g/mol
- Monoisotopic mass
- 312.95998
Names & identifiers
- Preferred name
- 6-Iodo-2-methylquinoline-4-carboxylic acid
- IUPAC
- 6-iodo-2-methylquinoline-4-carboxylic acid
- English name
- CHEMBRDG-BB 6874419
- Molecular formula
- C11H8INO2
- Molecular weight
- 313.09
Names & synonyms
6-iodo-2-methylquinoline-4-carboxylic acid433244-12-3MFCD031453506-iodo-2-methyl-quinoline-4-carboxylic AcidCambridge id 6874419SCHEMBL1441639DTXSID10355396AKOS0032274746-Iodo-2-methylquinoline-4-carboxylicacid6-Iodo-2-methyl-4-quinolinecarboxylic acidDB-186363AB00122238-01
Show more names
BUTTPARK 180\07-68CHEMBRDG-BB 68744194-Quinolinecarboxylic acid, 6-iodo-2-methyl-6-iodo-2-methylquinoline-4-carboxylic acid(SALTDATA: FREE)
F315226SR-01000245312SR-01000245312-1
Database identifiers
- CAS
433244-12-3- PubChem CID
- 799167
- DTXSID
DTXSID10355396
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
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Compound notes
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