7-Chloro-8-methoxy-isoquinoline-3-carboxylic acid

HCID 66940366
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Basic information

Standard SMILES
COc1c(Cl)ccc2cc(C(=O)O)ncc12
InChIKey
ONZRSCNAWIOWGV-UHFFFAOYSA-N
Molecular formula
C11H8ClNO3
Average molar mass
237.64 g/mol
Monoisotopic mass
237.0192708

Names & identifiers

Preferred name
7-Chloro-8-methoxy-isoquinoline-3-carboxylic acid
IUPAC
7-chloro-8-methoxyisoquinoline-3-carboxylic acid

Names & synonyms

SCHEMBL1201936ONZRSCNAWIOWGV-UHFFFAOYSA-N7-chloro-8-methoxy-isoquinoline-3-carboxylic acid

Database identifiers

PubChem CID
66940366

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
59.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
16

Related reactions

4 records
New reaction record

Compound notes

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