ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate (CAS 13337-64-9) — formula C21H25NO3, molecular weight 339.4; category organic chemicals.
| CAS Number | 13337-64-9 |
|---|---|
| Molecular Formula | C21H25NO3 |
| Molecular Weight | 339.4 |
| LogP | 3.6 |
| Category | Organic Chemicals |
ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is a carbon-based organic compound with CAS registry number 13337-64-9 and molecular formula C21H25NO3 (molecular weight 339.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13337-64-9
Its molecular formula C21H25NO3 comprises 21 C, 25 H, 1 N, 3 O atoms.
Also known as: ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate · 2,7,7-三甲基-5-氧代-4-苯基-1,4,5,6,7,8-六氢喹啉-3-甲酸乙酯
Category: organic chemicals
The CAS registry number of ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is 13337-64-9.
Molecular formula C21H25NO3, molecular weight 339.4.
It is also registered under: ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2,7,7-三甲基-5-氧代-4-苯基-1,4,5,6,7,8-六氢喹啉-3-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate (CAS 13337-64-9), compiled from public chemistry databases.
| CAS 号 | 13337-64-9 |
|---|---|
| PubChem CID | 202803 |
| 分子式 | C21H25NO3 |
| IUPAC 名称 | ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate |
| UNII（FDA） | HMS1423F20 |
| Molecular Weight | 339.4 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 339.18344366 |
| Monoisotopic Mass | 339.18344366 |
| Topological Polar Surface Area | 55.4 |
| Heavy Atom Count | 25 |
13337-64-9; 3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-phenyl-, ethyl ester; RefChem:1068773; ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate; ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate; BRN 0496405; ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate; 1,4,5,6,7,8-Hexahydro-5-oxo-4-phenyl-2,7,7-trimethyl-3-quinolinecarboxylic acid ethyl ester; Oprea1_017993; Oprea1_851304; CBDivE_011639; 3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-phenyl-2,7,7-trimethyl-, ethyl ester; 5-22-06-00426 (Beilstein Handbook Reference); IFLab1_004002; CHEMBL3409685; SCHEMBL20657021
2,7,7-三甲基-5-氧代-4-苯基-1,4,5,6,7,8-六氢喹啉-3-甲酸乙酯 · CAS 13337-64-9 · C21H25NO3. UNII HMS1423F20.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.