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Basic information
- CAS
156340-45-3- Standard SMILES
C=C[C@H]1CCC[C@@H]2N(C(=O)Oc3ccccc3)[C@H](CCC)CC(=O)[C@@]21O- InChIKey
AMHBGRQWIJZDEB-HPNQWNLUSA-N- Molecular formula
- C21H27NO4
- Average molar mass
- 357.45 g/mol
- Monoisotopic mass
- 357.19400834
Names & identifiers
- Preferred name
- Phenyl 5-ethenyl-4a-hydroxy-4-oxo-2-propyloctahydroquinoline-1(2H)-carboxylate
- IUPAC
- Phenyl (2R,4aS,5R,8aS)-5-ethenyl-4a-hydroxy-4-oxo-2-propyloctahydroquinoline-1(2H)-carboxylate
- English name
- decahydro-4a-hydroxy-4-oxo-2-propyl-5-vinylquinoline-1-carboxylic acid phenyl ester
- Molecular formula
- C21H27NO4
- Molecular weight
- 357.44
Names & synonyms
decahydro-4a-hydroxy-4-oxo-2-propyl-5-vinylquinoline-1-carboxylic acid phenyl ester1(2H)-Quinolinecarboxylic acid, 5-ethenyloctahydro-4a-hydroxy-4-oxo-2-propyl-, phenyl ester, (2R,4aS,5R,8aS)-rel-
Database identifiers
- CAS
156340-45-3- PubChem CID
- 190832
- DTXSID
DTXSID80935427
Properties
Physicochemical properties
- Boiling point
- 484.972 · 484.972±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.208 · 1.208±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.193 · 12.193±0.60(predicted)
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
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Compound notes
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