(1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid
TL;DR: (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid (CAS 105532-74-9) is a chemical compound with molecular formula C4H12O7P2 and molecular weight 234.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid
Also Known As: KST-1A0726, (1-hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid, 1-Hydroxyisobutylidenediphosphonicacid, (1-hydroxy-2-methylpropane-1,1-diyl)bis(phosphonic acid), Phosphonicacid, (1-hydroxy-2-methylpropylidene)bis- (9CI)
| Molecular Formula | C4H12O7P2 |
|---|---|
| Molecular Weight | 234.01 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.00583 |
| Heavy Atoms | 13 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 105532-74-9 |
|---|---|
| SMILES | CC(C)C(O)(P(=O)(O)O)P(=O)(O)O |
| InChIKey | OIRFFIYOMFBZAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid (CAS 105532-74-9), with molecular formula C4H12O7P2 and molecular weight 234.01 g/mol. IUPAC: (1-hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid.
Chemical Property Profile of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid
Property Insights of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid
The XLogP value of -2.7 indicates that (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid. Following Lipinski's Rule of Five, (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid?
The CAS number of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid is 105532-74-9.
What is the molecular formula of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid?
The molecular formula of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid is C4H12O7P2.
What is the molecular weight of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid?
The molecular weight of (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid is 234.01 g/mol.
Where can I buy (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid?
You can request a quote for (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for (1-Hydroxy-2-methyl-1-phosphonopropyl)phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.