AC1MJ36Q
methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: Oprea1_151268|Oprea1_803501|BAS 00410548|AG-690/36718013|SR-01000403400-1|methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate|4(4-ET-PH)2,7,7-TRI-ME-5-OXO-1,4,5,6,7,8-6H-QUINOLINE-3-CARBOXYLIC ACID ME ESTER
| Molecular Formula | C22H27NO3 |
|---|---|
| Molecular Weight | 353.1991 g/mol |
| LogP | 4.026 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.1991 |
| Monoisotopic Mass | 353.1991 |
| Heavy Atoms | 26 |
| Complexity | 812.29407 |
Chemical Identifiers
| CAS Number | 299945-45-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC)C |
Product Overview
AC1MJ36Q (CAS 299945-45-2), with molecular formula C22H27NO3 and molecular weight 353.1991 g/mol. IUPAC: methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
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