![3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol structure](/static/products/921/92111-04-1.png)
3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol
TL;DR: 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol (CAS 92111-04-1) is a chemical compound with molecular formula C13H21Cl2N2O3P and molecular weight 354.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol
Also Known As: 3-[[bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol
| Molecular Formula | C13H21Cl2N2O3P |
|---|---|
| Molecular Weight | 354.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 354.06668 |
| Heavy Atoms | 21 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 92111-04-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)OP(=O)(NCCCO)N(CCCl)CCCl |
| InChIKey | BWFAPIMLXMGDHC-UHFFFAOYSA-N |
Product Overview
3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol (CAS 92111-04-1), with molecular formula C13H21Cl2N2O3P and molecular weight 354.07 g/mol. IUPAC: 3-[[bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol.
Chemical Property Profile of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol
Property Insights of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol. Following Lipinski's Rule of Five, 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol has 2 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 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol?
The CAS number of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol is 92111-04-1.
What is the molecular formula of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol?
The molecular formula of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol is C13H21Cl2N2O3P.
What is the molecular weight of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol?
The molecular weight of 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol is 354.07 g/mol.
Where can I buy 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol?
You can request a quote for 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-[[Bis(2-chloroethyl)amino-phenoxyphosphoryl]amino]propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.