Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester
TL;DR: Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester (CAS 62064-18-0) is a chemical compound with molecular formula C6H10Cl2NO5P and molecular weight 276.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-[2-chloroethoxy(2-nitroethenyl)phosphoryl]oxyethane
Also Known As: bis(2-chloroethyl) 2-nitroethenylphosphonate, Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester, Bis(2-chloroethyl) (2-nitroethen-1-yl)phosphonate, 1-chloro-2-[2-chloroethoxy(2-nitroethenyl)phosphoryl]oxyethane, RefChem:370456
| Molecular Formula | C6H10Cl2NO5P |
|---|---|
| Molecular Weight | 276.97 g/mol |
| LogP | 2.4382 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 276.96738 |
| Heavy Atoms | 15 |
| Complexity | 260.24786 |
Chemical Identifiers
| CAS Number | 62064-18-0 |
|---|---|
| SMILES | C(CCl)OP(=O)(C=C[N+](=O)[O-])OCCCl |
Product Overview
Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester (CAS 62064-18-0), with molecular formula C6H10Cl2NO5P and molecular weight 276.97 g/mol. IUPAC: 1-chloro-2-[2-chloroethoxy(2-nitroethenyl)phosphoryl]oxyethane.
Chemical Property Profile of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester
Property Insights of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester
The XLogP value of 2.4382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester. Following Lipinski's Rule of Five, Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester 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 Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester?
The CAS number of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester is 62064-18-0.
What is the molecular formula of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester?
The molecular formula of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester is C6H10Cl2NO5P.
What is the molecular weight of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester?
The molecular weight of Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester is 276.97 g/mol.
Where can I buy Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester?
You can request a quote for Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) 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-nitroethenyl)-, bis(2-chloroethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (2-nitroethenyl)-, bis(2-chloroethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.