丁酰磷酸
TL;DR: 丁酰磷酸 (CAS 4378-06-7) is a chemical compound with molecular formula C4H9O5P and molecular weight 168.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁酰磷酸
phosphono butanoate
Also Known As: butanoyl phosphate, butyryl phosphate, Butanoylphosphate, butanoyl dihydrogen phosphate, phosphono butanoate
| Molecular Formula | C4H9O5P |
|---|---|
| Molecular Weight | 168.02 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.01875 |
| Heavy Atoms | 10 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 4378-06-7 |
|---|---|
| SMILES | CCCC(=O)OP(=O)(O)O |
| InChIKey | JSHMCUNOMIZJDJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁酰磷酸 (CAS 4378-06-7), with molecular formula C4H9O5P and molecular weight 168.02 g/mol. IUPAC: phosphono butanoate.
Chemical Property Profile of 丁酰磷酸
Property Insights of 丁酰磷酸
The XLogP value of -0.7 indicates that 丁酰磷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 丁酰磷酸. Following Lipinski's Rule of Five, 丁酰磷酸 has 2 hydrogen bond donor(s) and 5 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 丁酰磷酸?
The CAS number of 丁酰磷酸 is 4378-06-7.
What is the molecular formula of 丁酰磷酸?
The molecular formula of 丁酰磷酸 is C4H9O5P.
What is the molecular weight of 丁酰磷酸?
The molecular weight of 丁酰磷酸 is 168.02 g/mol.
Where can I buy 丁酰磷酸?
You can request a quote for 丁酰磷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁酰磷酸?
Yes, KEHONG BIO provides custom synthesis services for 丁酰磷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.