4-Chloro-2-methyl-8-methylsulfanylquinoline
Basic information
- CAS
63010-47-9- Standard SMILES
CSc1cccc2c(Cl)cc(C)nc12- InChIKey
RVOOGDIEOOFFGT-UHFFFAOYSA-N- Molecular formula
- C11H10ClNS
- Average molar mass
- 223.72 g/mol
- Monoisotopic mass
- 223.0222482
Names & identifiers
- Preferred name
- 4-Chloro-2-methyl-8-methylsulfanylquinoline
- IUPAC
- 4-chloro-2-methyl-8-methylsulfanylquinoline
Names & synonyms
63010-47-94-chloro-2-methyl-8-methylsulfanylquinoline4-Chloro-2-methyl-8-(methylthio)quinolineQuinoline,4-chloro-2-methyl-8-(methylthio)-4-chloro-2-methyl-8-(methylsulfanyl)quinolineNSC31380SCHEMBL3052063DTXSID50283422RVOOGDIEOOFFGT-UHFFFAOYSA-NNSC-31380
Database identifiers
- CAS
63010-47-9- PubChem CID
- 233198
- DTXSID
DTXSID50283422- Nikkaji
- J2.289.087E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 200
Related reactions
6 records
Compound notes
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