(3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate
TL;DR: (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate (CAS 102186-02-7) is a chemical compound with molecular formula C5H14O8P2 and molecular weight 264.0164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-hydroxy-3-methylbutyl) phosphono hydrogen phosphate
Also Known As: 3-hydroxy-3-methyl-butanyl pyrophosphate, (3-hydroxy-3-methylbutyl) phosphono hydrogen phosphate, (S)-4-BROMO-3-HYDROXY-3-METHYLBUTYL DIPHOSPHATE, [hydroxy-(3-hydroxy-3-methyl-butoxy)phosphoryl]oxyphosphonic Acid, SBH
Technical Specifications
| Molecular Formula | C5H14O8P2 |
| Molecular Weight | 264.0164 g/mol |
| XLogP | -2.4 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.0164 Da |
| Heavy Atoms | 15 |
| Complexity | 293.0 |
| SMILES | CC(C)(CCOP(=O)(O)OP(=O)(O)O)O |
| InChIKey | RZFCFDAITMFIMJ-UHFFFAOYSA-N |
Chemical Property Profile of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate
Property Insights of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate
The XLogP value of -2.4 indicates that (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate. Following Lipinski's Rule of Five, (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate?
The CAS number of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate is 102186-02-7.
What is the molecular formula of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate?
The molecular formula of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate is C5H14O8P2.
What is the molecular weight of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate?
The molecular weight of (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate is 264.0164 g/mol.
Where can I buy (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate?
You can request a quote for (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate?
Yes, CoreyChem provides custom synthesis services for (3-Hydroxy-3-methylbutyl) phosphono hydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.