Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate
TL;DR: Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate (CAS 137888-37-0) is a chemical compound with molecular formula C12H24Cl3O5P and molecular weight 384.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(1-chloropropan-2-yl) 3-(3-chloropropoxy)propyl phosphate
Also Known As: Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate, bis(1-chloropropan-2-yl) 3-(3-chloropropoxy)propyl phosphate, Bis(2-chloro-1-methylethyl) 3-(3-chloropropoxy)propyl phosphate, Bis(2-chloro-1-methylethyl) 3-(3-chloropropoxy)propyl phosphate #
| Molecular Formula | C12H24Cl3O5P |
|---|---|
| Molecular Weight | 384.04 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 384.0427 |
| Heavy Atoms | 21 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 137888-37-0 |
|---|---|
| SMILES | CC(CCl)OP(=O)(OCCCOCCCCl)OC(C)CCl |
| InChIKey | VCGVMOQWIMIGCQ-UHFFFAOYSA-N |
Product Overview
Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate (CAS 137888-37-0), with molecular formula C12H24Cl3O5P and molecular weight 384.04 g/mol. IUPAC: bis(1-chloropropan-2-yl) 3-(3-chloropropoxy)propyl phosphate.
Chemical Property Profile of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate
Property Insights of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate. With a topological polar surface area (TPSA) of 54.0 Ų, Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate has 0 hydrogen bond donor(s) and 5 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 Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate?
The CAS number of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate is 137888-37-0.
What is the molecular formula of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate?
The molecular formula of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate is C12H24Cl3O5P.
What is the molecular weight of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate?
The molecular weight of Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate is 384.04 g/mol.
Where can I buy Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate?
You can request a quote for Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Bis(1-chloro-2-propyl)-3-(3-chloropropoxy)propyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.