1-Methylisoquinolin-5-ol
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Basic information
- CAS
20335-65-3- Standard SMILES
Cc1nccc2c(O)cccc12- InChIKey
BKMZNTDCSUNCMV-UHFFFAOYSA-N- Molecular formula
- C10H9NO
- Average molar mass
- 159.18 g/mol
- Monoisotopic mass
- 159.06841391
Names & identifiers
- Preferred name
- 1-Methylisoquinolin-5-ol
- IUPAC
- 1-methylisoquinolin-5-ol
- English name
- 5-Isoquinolinol,1-methyl-(8CI,9CI)
- Molecular formula
- C10H9NO
- Molecular weight
- 159.18
Names & synonyms
1-Methylisoquinolin-5-ol20335-65-35-Isoquinolinol, 1-methyl-5-hydroxy-1-methylisoquinolineCHEMBL133542SCHEMBL1564280BKMZNTDCSUNCMV-UHFFFAOYSA-N5-Isoquinolinol,1-methyl-(8CI,9CI)
Database identifiers
- CAS
20335-65-3- PubChem CID
- 17830641
- ChEMBL
CHEMBL133542
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
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Related reactions
2 records
Compound notes
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