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4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene structure
Fine Chemical

4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene

TL;DR: 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene (CAS 128889-42-9) is a chemical compound with molecular formula C22H16N2O3 and molecular weight 356.1161 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-(4-nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene

Also Known As: 2-(4-nitrophenyl)-6,6-diphenyl-4-oxa-3-azabicyclo[3.1.0]hex-2-ene, 4-(4-nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene

CAS Number
128889-42-9
Molecular Formula
C22H16N2O3
Molecular Weight
356.1161 g/mol
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Technical Specifications

Molecular FormulaC22H16N2O3
Molecular Weight356.1161 g/mol
XLogP4.9
Topological Polar Surface Area (TPSA)67.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass356.1161 Da
Heavy Atoms27
Complexity575.0
SMILESC1=CC=C(C=C1)C2(C3C2ON=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5
InChIKeyOYSKUIOHXZPLOM-UHFFFAOYSA-N

Chemical Property Profile of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene

XLogP
4.9
TPSA (Topological Polar Surface Area)
67.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
27
Complexity
575.0
Exact Mass
356.1161
Monoisotopic Mass
356.1161
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene

The XLogP value of 4.9 indicates that 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene. Following Lipinski's Rule of Five, 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene?

The CAS number of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene is 128889-42-9.

What is the molecular formula of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene?

The molecular formula of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene is C22H16N2O3.

What is the molecular weight of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene?

The molecular weight of 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene is 356.1161 g/mol.

Where can I buy 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene?

You can request a quote for 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene?

Yes, CoreyChem provides custom synthesis services for 4-(4-Nitrophenyl)-6,6-diphenyl-2-oxa-3-azabicyclo[3.1.0]hex-3-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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