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Basic information
- CAS
58868-33-0- Standard SMILES
COc1ccc(OC)c2c(C)ccnc12- InChIKey
NTCXGWIDEYATBA-UHFFFAOYSA-N- Molecular formula
- C12H13NO2
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.09462866
Names & identifiers
- Preferred name
- 5,8-Dimethoxy-4-methylquinoline
- IUPAC
- 5,8-dimethoxy-4-methylquinoline
Names & synonyms
5,8-Dimethoxy-4-methylquinoline58868-33-0DTXSID50327890RefChem:298956DTXCID90279001Quinoline, 5,8-dimethoxy-4-methyl-NSC699978CHEMBL1896903NSC-699978NCGC00184211-01NCI60_035860AE-508/43283516
Database identifiers
- CAS
58868-33-0- PubChem CID
- 395433
- DTXSID
DTXSID50327890- ChEMBL
CHEMBL1896903
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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