2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop
TL;DR: 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop (CAS 6650-96-0) is a chemical compound with molecular formula C8H14Cl4NO2P and molecular weight 326.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-chloroethyl)-N-[chloromethyl(3-chloroprop-2-enoxy)phosphoryl]ethanamine
Also Known As: 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop, 2-chloro-N-(2-chloroethyl)-N-[chloromethyl(3-chloroprop-2-enoxy)phosphoryl]ethanamine, 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop-2-enoxy]phosphoryl]ethanamine
| Molecular Formula | C8H14Cl4NO2P |
|---|---|
| Molecular Weight | 326.95 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 326.95163 |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 6650-96-0 |
|---|---|
| SMILES | C(CCl)N(CCCl)P(=O)(CCl)OCC=CCl |
| InChIKey | GUJUZXRKQKOHGT-UHFFFAOYSA-N |
Product Overview
2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop (CAS 6650-96-0), with molecular formula C8H14Cl4NO2P and molecular weight 326.95 g/mol. IUPAC: 2-chloro-N-(2-chloroethyl)-N-[chloromethyl(3-chloroprop-2-enoxy)phosphoryl]ethanamine.
Chemical Property Profile of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop
Property Insights of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop. With a topological polar surface area (TPSA) of 29.5 Ų, 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop 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 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop?
The CAS number of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop is 6650-96-0.
What is the molecular formula of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop?
The molecular formula of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop is C8H14Cl4NO2P.
What is the molecular weight of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop?
The molecular weight of 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop is 326.95 g/mol.
Where can I buy 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop?
You can request a quote for 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2-chloroethyl)-N-[chloromethyl-[(E)-3-chloroprop and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.