Dichloromethyl O,O-diphenyl phosphonate
TL;DR: Dichloromethyl O,O-diphenyl phosphonate (CAS 40911-36-2) is a chemical compound with molecular formula C13H11Cl2O3P and molecular weight 315.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[dichloromethyl(phenoxy)phosphoryl]oxybenzene
Also Known As: Dichloromethyl O,O-diphenyl phosphonate, [dichloromethyl(phenoxy)phosphoryl]oxybenzene, diphenyl (dichloromethyl)phosphonate, dichloromethylO,O-diphenylphosphonate, (Dichloromethyl)phosphonic acid, diphenyl
| Molecular Formula | C13H11Cl2O3P |
|---|---|
| Molecular Weight | 315.98 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.9823 |
| Heavy Atoms | 19 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 40911-36-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OP(=O)(C(Cl)Cl)OC2=CC=CC=C2 |
| InChIKey | JYVKVDGSFLTXME-UHFFFAOYSA-N |
Product Overview
Dichloromethyl O,O-diphenyl phosphonate (CAS 40911-36-2), with molecular formula C13H11Cl2O3P and molecular weight 315.98 g/mol. IUPAC: [dichloromethyl(phenoxy)phosphoryl]oxybenzene.
Chemical Property Profile of Dichloromethyl O,O-diphenyl phosphonate
Property Insights of Dichloromethyl O,O-diphenyl phosphonate
The XLogP value of 4.5 indicates that Dichloromethyl O,O-diphenyl phosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Dichloromethyl O,O-diphenyl phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dichloromethyl O,O-diphenyl 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 Dichloromethyl O,O-diphenyl phosphonate?
The CAS number of Dichloromethyl O,O-diphenyl phosphonate is 40911-36-2.
What is the molecular formula of Dichloromethyl O,O-diphenyl phosphonate?
The molecular formula of Dichloromethyl O,O-diphenyl phosphonate is C13H11Cl2O3P.
What is the molecular weight of Dichloromethyl O,O-diphenyl phosphonate?
The molecular weight of Dichloromethyl O,O-diphenyl phosphonate is 315.98 g/mol.
Where can I buy Dichloromethyl O,O-diphenyl phosphonate?
You can request a quote for Dichloromethyl O,O-diphenyl phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichloromethyl O,O-diphenyl phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dichloromethyl O,O-diphenyl phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.