Tris(3-nitrophenyl)arsane oxide
TL;DR: Tris(3-nitrophenyl)arsane oxide (CAS 6310-27-6) is a chemical compound with molecular formula C18H12AsN3O7 and molecular weight 456.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bis(3-nitrophenyl)arsoryl-3-nitrobenzene
Also Known As: tris(3-nitrophenyl)arsane oxide, tri(m-nitrophenyl)arsine oxide, 1-bis(3-nitrophenyl)arsoryl-3-nitrobenzene, Tris(3-nitrophenyl)(oxo)-lambda~5~-arsane
| Molecular Formula | C18H12AsN3O7 |
|---|---|
| Molecular Weight | 456.99 g/mol |
| LogP | 1.8086 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.9891 |
| Heavy Atoms | 29 |
| Complexity | 596.0 |
Chemical Identifiers
| CAS Number | 6310-27-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[As](=O)(C2=CC=CC(=C2)[N+](=O)[O-])C3=CC=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | DXHPXSCLXFSXRO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tris(3-nitrophenyl)arsane oxide (CAS 6310-27-6), with molecular formula C18H12AsN3O7 and molecular weight 456.99 g/mol. IUPAC: 1-bis(3-nitrophenyl)arsoryl-3-nitrobenzene.
Chemical Property Profile of Tris(3-nitrophenyl)arsane oxide
Property Insights of Tris(3-nitrophenyl)arsane oxide
The XLogP value of 1.8086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tris(3-nitrophenyl)arsane oxide. The TPSA of 155.0 Ų indicates high polarity, suggesting Tris(3-nitrophenyl)arsane oxide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tris(3-nitrophenyl)arsane oxide has 0 hydrogen bond donor(s) and 7 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 Tris(3-nitrophenyl)arsane oxide?
The CAS number of Tris(3-nitrophenyl)arsane oxide is 6310-27-6.
What is the molecular formula of Tris(3-nitrophenyl)arsane oxide?
The molecular formula of Tris(3-nitrophenyl)arsane oxide is C18H12AsN3O7.
What is the molecular weight of Tris(3-nitrophenyl)arsane oxide?
The molecular weight of Tris(3-nitrophenyl)arsane oxide is 456.99 g/mol.
Where can I buy Tris(3-nitrophenyl)arsane oxide?
You can request a quote for Tris(3-nitrophenyl)arsane oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(3-nitrophenyl)arsane oxide?
Yes, KEHONG BIO provides custom synthesis services for Tris(3-nitrophenyl)arsane oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.