Ethylmethylquinoline
Basic information
- CAS
76602-24-9- Standard SMILES
CCc1cc(C)nc2ccccc12- InChIKey
UNCNHFIHYIDOIF-UHFFFAOYSA-N- Molecular formula
- C12H13N
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.10479942
Names & identifiers
- Preferred name
- Ethylmethylquinoline
- IUPAC
- 4-ethyl-2-methylquinoline
Names & synonyms
4-ethyl-2-methylquinolineETHYLMETHYLQUINOLINE76602-24-94-ethyl-2-methyl-quinoline73348-49-9SCHEMBL6985541SCHEMBL8232676DTXSID50227422AKOS006370969DB-118000
Database identifiers
- CAS
76602-24-9- PubChem CID
- 53520
- DTXSID
DTXSID50227422
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 167
Related reactions
1 records
Compound notes
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