AC1Q6KXP
4-(4-prop-2-ynoxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: 5-21-10-00186 (Beilstein Handbook Reference)|4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(2-propynyloxy)phenyl)-|AF-409/11072005|2-[4-(prop-2-yn-1-yloxy)phenyl]-3a,4,7,7a-tetrahydro-1h-4,7-methanoisoindole-1,3(2h)-dione|3a,4,7,7a-Tetrahydro-2-(4-(2-propynyloxy)phenyl)-4,7-methano-1H-isoindole-1,3(2H)-dione|N-(4-Propargiloksyfenylo)-imid kwasu cis-3,6-endometyleno-1,2,3,6-tetrahydroftalowego (polish)|2-(4-prop-2-ynyloxy-phenyl)-3a,4,7,7a-tetrahydro-4,7-methano-isoindole-1,3-dione|2-{4-[(Prop-2-yn-1-yl)oxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
| Molecular Formula | C18H15NO3 |
|---|---|
| Molecular Weight | 293.1052 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.1052 |
| Monoisotopic Mass | 293.1052 |
| Heavy Atoms | 22 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 5471-86-3 |
|---|---|
| SMILES | C#CCOC1=CC=C(C=C1)N2C(=O)C3C4CC(C3C2=O)C=C4 |
| InChIKey | AYWSRQACJRZHIY-UHFFFAOYSA-N |
Product Overview
AC1Q6KXP (CAS 5471-86-3), with molecular formula C18H15NO3 and molecular weight 293.1052 g/mol. IUPAC: 4-(4-prop-2-ynoxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
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