4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate
TL;DR: 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate (CAS 29523-71-5) is a chemical compound with molecular formula C14H20N3O4P and molecular weight 325.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,2-dimethylaziridin-1-yl)-(4-nitrophenoxy)phosphoryl]-2,2-dimethylaziridine
Also Known As: 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate, 4-Nitrophenyl bis(2,2-dimethylaziridin-1-yl)phosphinate, 1-[(2,2-dimethylaziridin-1-yl)-(4-nitrophenoxy)phosphoryl]-2, 1-[(2,2-dimethylaziridin-1-yl)-(4-nitrophenoxy)phosphoryl]-2,2-dimethylaziridine
| Molecular Formula | C14H20N3O4P |
|---|---|
| Molecular Weight | 325.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.11914 |
| Heavy Atoms | 22 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 29523-71-5 |
|---|---|
| SMILES | CC1(CN1P(=O)(N2CC2(C)C)OC3=CC=C(C=C3)[N+](=O)[O-])C |
| InChIKey | UBZWEUKYFOFHMM-UHFFFAOYSA-N |
Product Overview
4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate (CAS 29523-71-5), with molecular formula C14H20N3O4P and molecular weight 325.12 g/mol. IUPAC: 1-[(2,2-dimethylaziridin-1-yl)-(4-nitrophenoxy)phosphoryl]-2,2-dimethylaziridine.
Chemical Property Profile of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate
Property Insights of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate. Following Lipinski's Rule of Five, 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate has 0 hydrogen bond donor(s) and 6 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 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate?
The CAS number of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate is 29523-71-5.
What is the molecular formula of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate?
The molecular formula of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate is C14H20N3O4P.
What is the molecular weight of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate?
The molecular weight of 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate is 325.12 g/mol.
Where can I buy 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate?
You can request a quote for 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrophenyl bis[(2,2-dimethylaziridin-1-yl)]phosphinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.