Dipropan-2-yl(chloromethyl)phosphonate
TL;DR: Dipropan-2-yl(chloromethyl)phosphonate (CAS 86944-35-6) is a chemical compound with molecular formula C7H16ClO3P and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[chloromethyl(propan-2-yloxy)phosphoryl]oxypropane
Also Known As: dipropan-2-yl(chloromethyl)phosphonate, Di(propan-2-yl) (chloromethyl)phosphonate, bis(propan-2-yl) (chloromethyl)phosphonate, Chloromethylphosphonic acid diisopropyl ester, (Chloromethyl)phosphonic acid diisopropyl ester
| Molecular Formula | C7H16ClO3P |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.05257 |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 86944-35-6 |
|---|---|
| SMILES | CC(C)OP(=O)(CCl)OC(C)C |
| InChIKey | RRUMQPNMIBQQTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dipropan-2-yl(chloromethyl)phosphonate (CAS 86944-35-6), with molecular formula C7H16ClO3P and molecular weight 214.05 g/mol. IUPAC: 2-[chloromethyl(propan-2-yloxy)phosphoryl]oxypropane.
Chemical Property Profile of Dipropan-2-yl(chloromethyl)phosphonate
Property Insights of Dipropan-2-yl(chloromethyl)phosphonate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dipropan-2-yl(chloromethyl)phosphonate. With a topological polar surface area (TPSA) of 35.5 Ų, Dipropan-2-yl(chloromethyl)phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dipropan-2-yl(chloromethyl)phosphonate 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 Dipropan-2-yl(chloromethyl)phosphonate?
The CAS number of Dipropan-2-yl(chloromethyl)phosphonate is 86944-35-6.
What is the molecular formula of Dipropan-2-yl(chloromethyl)phosphonate?
The molecular formula of Dipropan-2-yl(chloromethyl)phosphonate is C7H16ClO3P.
What is the molecular weight of Dipropan-2-yl(chloromethyl)phosphonate?
The molecular weight of Dipropan-2-yl(chloromethyl)phosphonate is 214.05 g/mol.
Where can I buy Dipropan-2-yl(chloromethyl)phosphonate?
You can request a quote for Dipropan-2-yl(chloromethyl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropan-2-yl(chloromethyl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dipropan-2-yl(chloromethyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.