Basic information
- CAS
46255-82-7- Standard SMILES
CC1=CC(C)(C)N(C)c2ccccc21- InChIKey
BWVDOMYGBPMGKV-UHFFFAOYSA-N- Molecular formula
- C13H17N
- Average molar mass
- 187.28 g/mol
- Monoisotopic mass
- 187.13609955
Names & identifiers
- Preferred name
- 1,2,2,4-Tetramethyl-1,2-dihydroquinoline
- IUPAC
- 1,2,2,4-tetramethylquinoline
- English name
- 1,2-Dihydro-1,2,2,4-tetramethylquinoline
- Molecular formula
- C13H17N
- Molecular weight
- 187.28
Names & synonyms
46255-82-71,2,2,4-tetramethyl-1,2-dihydroquinolineDTXSID10554963RefChem:214193DTXCID405057461,2,2,4-tetramethylquinoline1,2-DIHYDRO-1,2,2,4-TETRAMETHYLQUINOLINESCHEMBL2393621AKOS006311944Quinoline, 1,2-dihydro-1,2,2,4-tetramethyl-
Database identifiers
- CAS
46255-82-7- PubChem CID
- 14045708
- DTXSID
DTXSID10554963
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- Boiling point
- 131 · 131-132 °C(Press: 3 Torr)
- Density
- 0.95 · 0.950±0.06 g/cm3(Predicted)
- pka
- 5.05 · 5.05±0.60(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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