1,4,4,6,7-Pentamethyl-3,4-dihydroquinolin-2(1h)-one
Basic information
- CAS
6971-07-9- Standard SMILES
Cc1cc2c(cc1C)C(C)(C)CC(=O)N2C- InChIKey
XKZAISCYCNTUCC-UHFFFAOYSA-N- Molecular formula
- C14H19NO
- Average molar mass
- 217.31 g/mol
- Monoisotopic mass
- 217.14666423
Names & identifiers
- Preferred name
- 1,4,4,6,7-Pentamethyl-3,4-dihydroquinolin-2(1h)-one
- IUPAC
- 1,4,4,6,7-pentamethyl-3H-quinolin-2-one
Names & synonyms
6971-07-91,4,4,6,7-pentamethyl-3,4-dihydroquinolin-2(1h)-oneNSC19660DTXSID90281003NSC-19660
Database identifiers
- CAS
6971-07-9- PubChem CID
- 227701
- DTXSID
DTXSID90281003
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 297
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Compound notes
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