Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester
TL;DR: Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester (CAS 7316-55-4) is a chemical compound with molecular formula C9H18Cl3O3P and molecular weight 310.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-[1-chloropropan-2-yl(1-chloropropan-2-yloxy)phosphoryl]oxypropane
Also Known As: Bis-(2-chloroisopropyl)-2-chloro-isopropyl phosphonate, Bis(2-chloro-1-methylethyl) (2-chloro-1-methylethyl)phosphonate, 2-Chloro-1-methylethylphosphonic acid bis(2-chloro-1-methylethyl) ester, bis(1-chloropropan-2-yl)(1-chloropropan-2-yl)phosphonate, bis(1-chloropropan-2-yl) (1-chloropropan-2-yl)phosphonate
| Molecular Formula | C9H18Cl3O3P |
|---|---|
| Molecular Weight | 310.01 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 310.00592 |
| Heavy Atoms | 16 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 7316-55-4 |
|---|---|
| SMILES | CC(CCl)OP(=O)(C(C)CCl)OC(C)CCl |
| InChIKey | AOTIRVBHFRETEJ-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester (CAS 7316-55-4), with molecular formula C9H18Cl3O3P and molecular weight 310.01 g/mol. IUPAC: 1-chloro-2-[1-chloropropan-2-yl(1-chloropropan-2-yloxy)phosphoryl]oxypropane.
Chemical Property Profile of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester
Property Insights of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester. With a topological polar surface area (TPSA) of 35.5 Ų, Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester 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 Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester?
The CAS number of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester is 7316-55-4.
What is the molecular formula of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester?
The molecular formula of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester is C9H18Cl3O3P.
What is the molecular weight of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester?
The molecular weight of Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester is 310.01 g/mol.
Where can I buy Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester?
You can request a quote for Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (2-chloro-1-methylethyl)-, bis(2-chloro-1-methylethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.