Basic information
- CAS
58868-28-3- Standard SMILES
COc1ccc(OC)c2c(C)c(C)c(Cl)nc12- InChIKey
LLZYHJQXJGNLEU-UHFFFAOYSA-N- Molecular formula
- C13H14ClNO2
- Average molar mass
- 251.71 g/mol
- Monoisotopic mass
- 251.0713064
Names & identifiers
- Preferred name
- 2-Chloro-5,8-dimethoxy-3,4-dimethylquinoline
- IUPAC
- 2-chloro-5,8-dimethoxy-3,4-dimethylquinoline
Names & synonyms
2-chloro-5,8-dimethoxy-3,4-dimethylquinoline58868-28-3NSC 279007NSC279007DTXSID70313952NSC-279007
Database identifiers
- CAS
58868-28-3- PubChem CID
- 322286
- DTXSID
DTXSID70313952
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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