AC1LTIXI
3,3,6,6-tetramethyl-9-(4-nitrophenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
Also Known As: ChemDiv1_010815|Oprea1_434549|HMS617L13|J1.810.626D|3,3,6,6-tetramethyl-9-(4-nitrophenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione|SR-01000509933-1|3,3,6,6-tetramethyl-9-(4-nitrophenyl)-2,3,4,5,6,7,8,9-octahydro-1H-xanthene-1,8-dione|A0601/0027810|3,3,6,6-tetramethyl-9-(4-nitrophenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione|2,3,4,5,6,7-Hexahydro-3,3,6,6-tetramethyl-9-(4-nitrophenyl)-9H-xanthene-1,8-dione|3,3,6,6-Tetramethyl-2,3,4,5,6,7-hexahydro-9-(4-nitrophenyl)-9H-xanthene-1,8-dione|3,3,6,6-Tetramethyl-9-(4-nitrophenyl)-1,2,3,4,5,6,7,8-octahydro-9H-xanthene-1,8-dione|3,3,6,6-Tetramethyl-9-(4-nitrophenyl)-2,3,4,5,6,7-hexahydro-9H-xanthene-1,8-dione|3,3,6,6-Tetramethyl-9-(4-nitrophenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione|3,3,6,6-Tetramethyl-9-(4-nitrophenyl)-3,4,5,6-tetrahydro-9H-xanthene-1,8(2H,7H)-dione|3,4,5,6,7,9-Hexahydro-3,3,6,6-tetramethyl-9-(4-nitrophenyl)-1H-xanthene-1,8(2H)-dione|9-(4-Nitrophenyl)-2,3,4,5,6,7-hexahydro-3,3,6,6-tetramethyl-9H-xanthene-1,8-dione|9-(4-Nitrophenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8-octahydro-9H-xanthene-1,8-dione|9-(4-nitrophenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8-octahydroxanthene-1,8-dione|9-(4-Nitrophenyl)-3,3,6,6-tetramethyl-2,3,4,5,6,7-hexahydro-1H-xanthene-1,8(9H)-dione|9-(4-Nitrophenyl)-3,3,6,6-tetramethyl-3,4,5,6-tetrahydro-9H-xanthene-1(2H),8(7H)-dione|9-(4-Nitrophenyl)-3,3,6,6-tetramethyl-3,4,5,6-tetrahydro-9H-xanthene-1,8(2H,7H)-dione|9beta-(4-Nitrophenyl)-1,2,3,4,5,6,7,8-octahydro-3,3,6,6-tetramethyl-9H-xanthene-1,8-dione
| Molecular Formula | C23H25NO5 |
|---|---|
| Molecular Weight | 395.17328 g/mol |
| LogP | 4.995 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 395.17328 |
| Monoisotopic Mass | 395.17328 |
| Heavy Atoms | 29 |
| Complexity | 942.5995 |
Chemical Identifiers
| CAS Number | 40588-46-3 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)C1)C |
Product Overview
AC1LTIXI (CAS 40588-46-3), with molecular formula C23H25NO5 and molecular weight 395.17328 g/mol. IUPAC: 3,3,6,6-tetramethyl-9-(4-nitrophenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione.
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