Bis(2-chloroethyl) prop-2-en-1-yl phosphate
TL;DR: Bis(2-chloroethyl) prop-2-en-1-yl phosphate (CAS 32670-89-6) is a chemical compound with molecular formula C7H13Cl2O4P and molecular weight 261.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-chloroethyl) prop-2-enyl phosphate
Also Known As: bis(2-chloroethyl) prop-2-en-1-yl phosphate, bis(2-chloroethyl) prop-2-enyl phosphate, 2,5-Dimethylen-1,6-hexadisaeurediethylester, 3-[Bis(2-chloroethoxy)phosphoryloxy]prop-1-ene
| Molecular Formula | C7H13Cl2O4P |
|---|---|
| Molecular Weight | 261.99 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 261.99286 |
| Heavy Atoms | 14 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 32670-89-6 |
|---|---|
| SMILES | C=CCOP(=O)(OCCCl)OCCCl |
| InChIKey | DAAUFCCLHPYMRU-UHFFFAOYSA-N |
Product Overview
Bis(2-chloroethyl) prop-2-en-1-yl phosphate (CAS 32670-89-6), with molecular formula C7H13Cl2O4P and molecular weight 261.99 g/mol. IUPAC: bis(2-chloroethyl) prop-2-enyl phosphate.
Chemical Property Profile of Bis(2-chloroethyl) prop-2-en-1-yl phosphate
Property Insights of Bis(2-chloroethyl) prop-2-en-1-yl phosphate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(2-chloroethyl) prop-2-en-1-yl phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, Bis(2-chloroethyl) prop-2-en-1-yl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-chloroethyl) prop-2-en-1-yl phosphate has 0 hydrogen bond donor(s) and 4 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(2-chloroethyl) prop-2-en-1-yl phosphate?
The CAS number of Bis(2-chloroethyl) prop-2-en-1-yl phosphate is 32670-89-6.
What is the molecular formula of Bis(2-chloroethyl) prop-2-en-1-yl phosphate?
The molecular formula of Bis(2-chloroethyl) prop-2-en-1-yl phosphate is C7H13Cl2O4P.
What is the molecular weight of Bis(2-chloroethyl) prop-2-en-1-yl phosphate?
The molecular weight of Bis(2-chloroethyl) prop-2-en-1-yl phosphate is 261.99 g/mol.
Where can I buy Bis(2-chloroethyl) prop-2-en-1-yl phosphate?
You can request a quote for Bis(2-chloroethyl) prop-2-en-1-yl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-chloroethyl) prop-2-en-1-yl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-chloroethyl) prop-2-en-1-yl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.