Dibutyl phosphoramidate
TL;DR: Dibutyl phosphoramidate (CAS 870-52-0) is a chemical compound with molecular formula C8H20NO3P and molecular weight 209.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[amino(butoxy)phosphoryl]oxybutane
Also Known As: Dibutyl phosphoramidate, Di-n-butyl phosphoroamidate, Dibutylphosphoramidate, PHOSPHORAMIDIC ACID, DIBUTYL ESTER, di-n-butyl phosphoramidate
| Molecular Formula | C8H20NO3P |
|---|---|
| Molecular Weight | 209.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 209.11809 |
| Heavy Atoms | 13 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 870-52-0 |
|---|---|
| SMILES | CCCCOP(=O)(N)OCCCC |
| InChIKey | BDBZFUCZCKJSIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibutyl phosphoramidate (CAS 870-52-0), with molecular formula C8H20NO3P and molecular weight 209.12 g/mol. IUPAC: 1-[amino(butoxy)phosphoryl]oxybutane.
Chemical Property Profile of Dibutyl phosphoramidate
Property Insights of Dibutyl phosphoramidate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibutyl phosphoramidate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibutyl phosphoramidate. Following Lipinski's Rule of Five, Dibutyl phosphoramidate has 1 hydrogen bond donor(s) and 4 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 Dibutyl phosphoramidate?
The CAS number of Dibutyl phosphoramidate is 870-52-0.
What is the molecular formula of Dibutyl phosphoramidate?
The molecular formula of Dibutyl phosphoramidate is C8H20NO3P.
What is the molecular weight of Dibutyl phosphoramidate?
The molecular weight of Dibutyl phosphoramidate is 209.12 g/mol.
Where can I buy Dibutyl phosphoramidate?
You can request a quote for Dibutyl phosphoramidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibutyl phosphoramidate?
Yes, KEHONG BIO provides custom synthesis services for Dibutyl phosphoramidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.