Heptyl methyl methylphosphonate
TL;DR: Heptyl methyl methylphosphonate (CAS 170275-60-2) is a chemical compound with molecular formula C9H21O3P and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[methoxy(methyl)phosphoryl]oxyheptane
Also Known As: Heptyl methyl methylphosphonate, 1-[methoxy(methyl)phosphoryl]oxyheptane, Methylphosphonic acid heptyl(methyl) ester, J2.252.761D, Phosphonic acid,methyl-,heptyl methyl ester (9CI)
| Molecular Formula | C9H21O3P |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 208.12283 |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 170275-60-2 |
|---|---|
| SMILES | CCCCCCCOP(=O)(C)OC |
| InChIKey | JZUXTBAFHRYUAL-UHFFFAOYSA-N |
Product Overview
Heptyl methyl methylphosphonate (CAS 170275-60-2), with molecular formula C9H21O3P and molecular weight 208.12 g/mol. IUPAC: 1-[methoxy(methyl)phosphoryl]oxyheptane.
Chemical Property Profile of Heptyl methyl methylphosphonate
Property Insights of Heptyl methyl methylphosphonate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptyl methyl methylphosphonate. With a topological polar surface area (TPSA) of 35.5 Ų, Heptyl methyl methylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl methyl methylphosphonate has 0 hydrogen bond donor(s) and 3 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 Heptyl methyl methylphosphonate?
The CAS number of Heptyl methyl methylphosphonate is 170275-60-2.
What is the molecular formula of Heptyl methyl methylphosphonate?
The molecular formula of Heptyl methyl methylphosphonate is C9H21O3P.
What is the molecular weight of Heptyl methyl methylphosphonate?
The molecular weight of Heptyl methyl methylphosphonate is 208.12 g/mol.
Where can I buy Heptyl methyl methylphosphonate?
You can request a quote for Heptyl methyl methylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl methyl methylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl methyl methylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.