TL;DR: Phosphoric acid, methyl ester (CAS 12789-45-6) is a chemical compound with molecular formula CH7O5P and molecular weight 130.00311 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methanol;phosphoric acid
Also Known As: H3PO4 methanol, METHYL PHOSPHATE, Methyl hydrogen phosphate, methanol; phosphoric acid, Phosphoric acid, methyl ester
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | CH7O5P |
| Molecular Weight | 130.00311 g/mol |
| XLogP | -1.32 |
| Topological Polar Surface Area (TPSA) | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.00311 Da |
| Heavy Atoms | 7 |
| Complexity | 51.0 |
| SMILES | CO.OP(=O)(O)O |
| InChIKey | LBDROUOCQSGOFI-UHFFFAOYSA-N |
The XLogP value of -1.32 indicates that Phosphoric acid, methyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, methyl ester. Following Lipinski's Rule of Five, Phosphoric acid, methyl ester has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phosphoric acid, methyl ester is 12789-45-6.
The molecular formula of Phosphoric acid, methyl ester is CH7O5P.
The molecular weight of Phosphoric acid, methyl ester is 130.00311 g/mol.
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