TL;DR: myo-Inositol, tetrakis(dihydrogen phosphate) (CAS 118354-65-7) is a chemical compound with molecular formula C6H16O18P4 and molecular weight 499.9287 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S,3R,4R,6R)-2,5-dihydroxy-3,4,6-triphosphonooxycyclohexyl] dihydrogen phosphate
Also Known As: IP4 TETRAPOTASSIUM, myo-Inositol, tetrakis(dihydrogen phosphate), myo-Inositol 1,2,4,5-tetrakisphosphate, D-myo-Inositol 1,2,4,5-tetraphosphoric acid, d-ins 1,2,4,5-tetrakisphosphate octasodium salt
| Molecular Formula | C6H16O18P4 |
| Molecular Weight | 499.9287 g/mol |
| XLogP | -8.1 |
| Topological Polar Surface Area (TPSA) | 308.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 8 |
| Exact Mass | 499.9287 Da |
| Heavy Atoms | 28 |
| Complexity | 604.0 |
| SMILES | [C@H]1([C@@H](C([C@H]([C@@H](C1O)OP(=O)(O)O)OP(=O)(O)O)O)OP(=O)(O)O)OP(=O)(O)O |
| InChIKey | ZAWIXNGTTZTBKV-BAHMFFLCSA-N |
The XLogP value of -8.1 indicates that myo-Inositol, tetrakis(dihydrogen phosphate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 308.0 Ų indicates high polarity, suggesting myo-Inositol, tetrakis(dihydrogen phosphate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, myo-Inositol, tetrakis(dihydrogen phosphate) has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of myo-Inositol, tetrakis(dihydrogen phosphate) is 118354-65-7.
The molecular formula of myo-Inositol, tetrakis(dihydrogen phosphate) is C6H16O18P4.
The molecular weight of myo-Inositol, tetrakis(dihydrogen phosphate) is 499.9287 g/mol.
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