Dimethyl (2-oxoheptyl)phosphonate
TL;DR: Dimethyl (2-oxoheptyl)phosphonate (CAS 37206-28-3) is a chemical compound with molecular formula C9H19O4P and molecular weight 222.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dimethoxyphosphorylheptan-2-one
Also Known As: Dimethyl (2-oxoheptyl)phosphonate, 1-dimethoxyphosphorylheptan-2-one, Dimethyl phosphonate, Dimethyl 2-oxoheptylphosphonate, dimethyl(2-oxoheptyl)phosphonate
| Molecular Formula | C9H19O4P |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 222.1021 |
| Heavy Atoms | 14 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 37206-28-3 |
|---|---|
| SMILES | CCCCCC(=O)CP(=O)(OC)OC |
| InChIKey | LQZCYXCHWNQBKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl (2-oxoheptyl)phosphonate (CAS 37206-28-3), with molecular formula C9H19O4P and molecular weight 222.10 g/mol. IUPAC: 1-dimethoxyphosphorylheptan-2-one.
Chemical Property Profile of Dimethyl (2-oxoheptyl)phosphonate
Property Insights of Dimethyl (2-oxoheptyl)phosphonate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl (2-oxoheptyl)phosphonate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl (2-oxoheptyl)phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl (2-oxoheptyl)phosphonate has 0 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 Dimethyl (2-oxoheptyl)phosphonate?
The CAS number of Dimethyl (2-oxoheptyl)phosphonate is 37206-28-3.
What is the molecular formula of Dimethyl (2-oxoheptyl)phosphonate?
The molecular formula of Dimethyl (2-oxoheptyl)phosphonate is C9H19O4P.
What is the molecular weight of Dimethyl (2-oxoheptyl)phosphonate?
The molecular weight of Dimethyl (2-oxoheptyl)phosphonate is 222.10 g/mol.
Where can I buy Dimethyl (2-oxoheptyl)phosphonate?
You can request a quote for Dimethyl (2-oxoheptyl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl (2-oxoheptyl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl (2-oxoheptyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.