Structure Info
- Chemspace ID
- CSCS00121704787 (Synthesis)
- MFCD
- MFCD00352949
- IUPAC Name
- butyl 4-(3-iodophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
- Mol formula
- C23H28INO3
- Mol weight
- 493 Da
- Catalog Number(s)
- AA029AQ2, AG-690/33355062, BL92934, CSC121704787, IBS-E0008747, OSSK_345908, STK045149, STOCK1S-18710
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.98
- Heavy atoms count
- 28
- Rotatable bond count
- 6
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.478
- Polar surface area (Å)
- 55
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00121704787
Items Overall 2 items from 1 supplier
Supplier | Lead time | Ships from | Purity | Pack | Price, € | Qty |
---|---|---|---|---|---|---|
A2B Chem | 35 days | United States To: | 95 | 10 mg | 370 | |
A2B Chem | 35 days | United States To: | 95 | 20 mg | 389 | |
Description: butyl 4-(3-iodophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate; CAS: 296262-94-7 |
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