3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3
TL;DR: 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 (CAS 22158-00-5) is a chemical compound with molecular formula C9H18Cl2N2O6P2 and molecular weight 382.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3λ5,9λ5-diphosphaspiro[5.5]undecane-3,9-diamine
Also Known As: 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3, n,n'-bis(2-chloroethyl)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane-3,9-diamine 3,9-dioxide, 3,9-Bis[(2-chloroethyl)amino]-2,4,8,10-tetraoxa-3lambda~5~,9lambda~5~-diphosphaspiro[5.5]undecane-3,9-dione, 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3lambda5,9lambda5-diphosphaspiro[5.5]undecane-3,9-diamine
| Molecular Formula | C9H18Cl2N2O6P2 |
|---|---|
| Molecular Weight | 382.00 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.0017 |
| Heavy Atoms | 21 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 22158-00-5 |
|---|---|
| SMILES | C1C2(COP(=O)(O1)NCCCl)COP(=O)(OC2)NCCCl |
| InChIKey | BQNMCPBUDBYXGJ-UHFFFAOYSA-N |
Product Overview
3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 (CAS 22158-00-5), with molecular formula C9H18Cl2N2O6P2 and molecular weight 382.00 g/mol. IUPAC: 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3λ5,9λ5-diphosphaspiro[5.5]undecane-3,9-diamine.
Chemical Property Profile of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3
Property Insights of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3
The XLogP value of -0.9 indicates that 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3. Following Lipinski's Rule of Five, 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 has 2 hydrogen bond donor(s) and 8 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 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3?
The CAS number of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 is 22158-00-5.
What is the molecular formula of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3?
The molecular formula of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 is C9H18Cl2N2O6P2.
What is the molecular weight of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3?
The molecular weight of 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 is 382.00 g/mol.
Where can I buy 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3?
You can request a quote for 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3?
Yes, KEHONG BIO provides custom synthesis services for 3-N,9-N-bis(2-chloroethyl)-3,9-dioxo-2,4,8,10-tetraoxa-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.