TL;DR: 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose (CAS 126193-17-7) is a chemical compound with molecular formula C31H36O6Sn and molecular weight 624.1534 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3aR,5R,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6-(triphenylstannylmethyl)-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-ol
Also Known As: Ph3SnCh2 Carbohydrate, 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose, (3aR,5R,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6-(triphenylstannylmethyl)-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-ol, 1,2:5,6-Bis-O-(1-methylethylidene)-3-C-((triphenylstannyl)methyl)-alpha-D-allofuranose, alpha-D-Allofuranose, 1,2:5,6-bis-O-(1-methylethylidene)-3-C-((triphenylstannyl)methyl)-
| Molecular Formula | C31H36O6Sn |
| Molecular Weight | 624.1534 g/mol |
| XLogP | 2.9158 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 624.1534 Da |
| Heavy Atoms | 38 |
| Complexity | 770.0 |
| SMILES | CC1(OC[C@@H](O1)[C@@H]2[C@@]([C@@H]3[C@H](O2)OC(O3)(C)C)(C[Sn](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O)C |
| InChIKey | AJWTYLBCPBESIW-GGBJYFKRSA-N |
The XLogP value of 2.9158 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose. Following Lipinski's Rule of Five, 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose is 126193-17-7.
The molecular formula of 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose is C31H36O6Sn.
The molecular weight of 3-C-((Triphenylstannyl)methyl)-1,2-5,6-di-O-isopropylidene-D-allofuranose is 624.1534 g/mol.
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