![3-Azabicyclo[3.1.0]hexane-2,4-dione structure](/static/products/1131/113111-34-5.webp)
3-Azabicyclo[3.1.0]hexane-2,4-dione
TL;DR: 3-Azabicyclo[3.1.0]hexane-2,4-dione (CAS 113111-34-5) is a chemical compound with molecular formula C5H5NO2 and molecular weight 111.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-azabicyclo[3.1.0]hexane-2,4-dione
Also Known As: 3-azabicyclo[3.1.0]hexane-2,4-dione, cyclopropane-1,2-dicarboximide, 3-azabicyclo[3.1.0]hexane-2,4dione, 3-azabicyclo(3.1.0)hexane-2,4-dione, 3-azabicyclo[3.1.0]hexane-2,4 dione
| Molecular Formula | C5H5NO2 |
|---|---|
| Molecular Weight | 111.03 g/mol |
| LogP | -0.7211 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.03203 |
| Heavy Atoms | 8 |
| Complexity | 157.26749 |
Chemical Identifiers
| CAS Number | 113111-34-5 |
|---|---|
| SMILES | C1C2C1C(=O)NC2=O |
Product Overview
3-Azabicyclo[3.1.0]hexane-2,4-dione (CAS 113111-34-5), with molecular formula C5H5NO2 and molecular weight 111.03 g/mol. IUPAC: 3-azabicyclo[3.1.0]hexane-2,4-dione.
Chemical Property Profile of 3-Azabicyclo[3.1.0]hexane-2,4-dione
Property Insights of 3-Azabicyclo[3.1.0]hexane-2,4-dione
The XLogP value of -0.7211 indicates that 3-Azabicyclo[3.1.0]hexane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.17 Ų, 3-Azabicyclo[3.1.0]hexane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Azabicyclo[3.1.0]hexane-2,4-dione has 1 hydrogen bond donor(s) and 2 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-Azabicyclo[3.1.0]hexane-2,4-dione?
The CAS number of 3-Azabicyclo[3.1.0]hexane-2,4-dione is 113111-34-5.
What is the molecular formula of 3-Azabicyclo[3.1.0]hexane-2,4-dione?
The molecular formula of 3-Azabicyclo[3.1.0]hexane-2,4-dione is C5H5NO2.
What is the molecular weight of 3-Azabicyclo[3.1.0]hexane-2,4-dione?
The molecular weight of 3-Azabicyclo[3.1.0]hexane-2,4-dione is 111.03 g/mol.
Where can I buy 3-Azabicyclo[3.1.0]hexane-2,4-dione?
You can request a quote for 3-Azabicyclo[3.1.0]hexane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Azabicyclo[3.1.0]hexane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Azabicyclo[3.1.0]hexane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.