1,2-Cyclobutanedicarboximide
TL;DR: 1,2-Cyclobutanedicarboximide (CAS 1122-09-4) is a chemical compound with molecular formula C6H7NO2 and molecular weight 125.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-azabicyclo[3.2.0]heptane-2,4-dione
Also Known As: 3-azabicyclo[3.2.0]heptane-2,4-dione, 1,2-Cyclobutanedicarboximide, 3-Azabicyclo(3.2.0)heptane-2,4-dione, [(3,5-difluorophenyl)amino](oxo)acetic acid, (1R,5S)-3-azabicyclo[3.2.0]heptane-2,4-dione
| Molecular Formula | C6H7NO2 |
|---|---|
| Molecular Weight | 125.05 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.047676 |
| Heavy Atoms | 9 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 1122-09-4 |
|---|---|
| SMILES | C1CC2C1C(=O)NC2=O |
| InChIKey | WXTZWJOCJKKBJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Cyclobutanedicarboximide (CAS 1122-09-4), with molecular formula C6H7NO2 and molecular weight 125.05 g/mol. IUPAC: 3-azabicyclo[3.2.0]heptane-2,4-dione.
Chemical Property Profile of 1,2-Cyclobutanedicarboximide
Property Insights of 1,2-Cyclobutanedicarboximide
The XLogP value of -0.5 indicates that 1,2-Cyclobutanedicarboximide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.2 Ų, 1,2-Cyclobutanedicarboximide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclobutanedicarboximide 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 1,2-Cyclobutanedicarboximide?
The CAS number of 1,2-Cyclobutanedicarboximide is 1122-09-4.
What is the molecular formula of 1,2-Cyclobutanedicarboximide?
The molecular formula of 1,2-Cyclobutanedicarboximide is C6H7NO2.
What is the molecular weight of 1,2-Cyclobutanedicarboximide?
The molecular weight of 1,2-Cyclobutanedicarboximide is 125.05 g/mol.
Where can I buy 1,2-Cyclobutanedicarboximide?
You can request a quote for 1,2-Cyclobutanedicarboximide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclobutanedicarboximide?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclobutanedicarboximide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.