AC1MFPXW
[2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate
Also Known As: Oprea1_844939|2-(4-chloro-3-nitrophenyl)-2-oxoethyl (1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetate|SR-01000234584-1|[2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate|[2-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]ethanoate|2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetic acid [2-(4-chloro-3-nitro-phenyl)-2-keto-ethyl] ester|2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetic acid [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] ester|2-(4-CHLORO-3-NITROPHENYL)-2-OXOETHYL 2-(1,3-DIOXO-3A,4,7,7A-TETRAHYDROISOINDOL-2-YL)ACETATE|2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-(1,3-dioxo-4,7,3a,7a-tetrahydroisoindo l-2-yl)acetate
| Molecular Formula | C18H15ClN2O7 |
|---|---|
| Molecular Weight | 406.0568 g/mol |
| LogP | 1.9253 |
| Topological Polar Surface Area | 123.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.0568 |
| Monoisotopic Mass | 406.0568 |
| Heavy Atoms | 28 |
| Complexity | 885.19525 |
Chemical Identifiers
| CAS Number | 6436-79-9 |
|---|---|
| SMILES | C1C=CCC2C1C(=O)N(C2=O)CC(=O)OCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-] |
Product Overview
AC1MFPXW (CAS 6436-79-9), with molecular formula C18H15ClN2O7 and molecular weight 406.0568 g/mol. IUPAC: [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate.