1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)
TL;DR: 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) (CAS 27091-25-4) is a chemical compound with molecular formula C10H10N4O4 and molecular weight 250.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(aziridin-1-yl)-2,4-dinitrophenyl]aziridine
Also Known As: 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine), 1-[5-(aziridin-1-yl)-2,4-dinitrophenyl]aziridine, Aziridine,1,1-(4,6-dinitro-1,3-phenylene)bis-(9ci)
| Molecular Formula | C10H10N4O4 |
|---|---|
| Molecular Weight | 250.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 97.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.0702 |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 27091-25-4 |
|---|---|
| SMILES | C1CN1C2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])N3CC3 |
| InChIKey | XRZSIFWILGJUOC-UHFFFAOYSA-N |
Product Overview
1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) (CAS 27091-25-4), with molecular formula C10H10N4O4 and molecular weight 250.07 g/mol. IUPAC: 1-[5-(aziridin-1-yl)-2,4-dinitrophenyl]aziridine.
Chemical Property Profile of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)
Property Insights of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine). The TPSA of 97.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine). Following Lipinski's Rule of Five, 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) 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 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)?
The CAS number of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) is 27091-25-4.
What is the molecular formula of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)?
The molecular formula of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) is C10H10N4O4.
What is the molecular weight of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)?
The molecular weight of 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) is 250.07 g/mol.
Where can I buy 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)?
You can request a quote for 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(4,6-Dinitro-1,3-phenylene)bis(aziridine) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.