TL;DR: (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione (CAS 1212299-91-6) is a chemical compound with molecular formula C16H10O4 and molecular weight 266.05792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-spiro[2-benzofuran-3,3'-4H-isochromene]-1,1'-dione
Also Known As: (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione, (3R)-spiro[2-benzofuran-3,3'-4H-isochromene]-1,1'-dione
| Molecular Formula | C16H10O4 |
| Molecular Weight | 266.05792 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 266.05792 Da |
| Heavy Atoms | 20 |
| Complexity | 446.0 |
| SMILES | C1C2=CC=CC=C2C(=O)O[C@@]13C4=CC=CC=C4C(=O)O3 |
| InChIKey | XNEWCZZSRLJDTQ-INIZCTEOSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione. With a topological polar surface area (TPSA) of 52.6 Ų, (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione is 1212299-91-6.
The molecular formula of (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione is C16H10O4.
The molecular weight of (R)-3H-spiro[isobenzofuran-1,3'-isochroman]-1',3-dione is 266.05792 g/mol.
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