Basic information
- Standard SMILES
COc1ccc2cc(C(=O)O)ncc2c1- InChIKey
CQVOLMIAFMVGMJ-UHFFFAOYSA-N- Molecular formula
- C11H9NO3
- Average molar mass
- 203.19 g/mol
Names & identifiers
- Preferred name
- 3-Isoquinolinecarboxylic acid, 7-methoxy-
- IUPAC
- 7-methoxyisoquinoline-3-carboxylic acid
Names & synonyms
7-methoxyisoquinoline-3-carboxylic Acid224321-76-03-Isoquinolinecarboxylic acid, 7-methoxy-SCHEMBL1203053CQVOLMIAFMVGMJ-UHFFFAOYSA-N7-methoxy-isoquinoline-3-carboxylic acidEN300-398300
Database identifiers
- PubChem CID
- 10822014
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Related reactions
7 records
Compound notes
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