Bis(methylamino)cyclobut-3-ene-1,2-dione
TL;DR: Bis(methylamino)cyclobut-3-ene-1,2-dione (CAS 52094-05-0) is a chemical compound with molecular formula C6H8N2O2 and molecular weight 140.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(methylamino)cyclobut-3-ene-1,2-dione
Also Known As: 3,4-bis(methylamino)cyclobut-3-ene-1,2-dione, bis(methylamino)cyclobut-3-ene-1,2-dione, 3,4-di(methylamino)cyclobut-3-ene-1,2-dione, J1.535.630H, 2,3-bis(methylamino)cyclobut-2-ene-1,4-dione
| Molecular Formula | C6H8N2O2 |
|---|---|
| Molecular Weight | 140.06 g/mol |
| LogP | -0.634 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.05858 |
| Heavy Atoms | 10 |
| Complexity | 277.47733 |
Chemical Identifiers
| CAS Number | 52094-05-0 |
|---|---|
| SMILES | CNC1=C(C(=O)C1=O)NC |
Product Overview
Bis(methylamino)cyclobut-3-ene-1,2-dione (CAS 52094-05-0), with molecular formula C6H8N2O2 and molecular weight 140.06 g/mol. IUPAC: 3,4-bis(methylamino)cyclobut-3-ene-1,2-dione.
Chemical Property Profile of Bis(methylamino)cyclobut-3-ene-1,2-dione
Property Insights of Bis(methylamino)cyclobut-3-ene-1,2-dione
The XLogP value of -0.634 indicates that Bis(methylamino)cyclobut-3-ene-1,2-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, Bis(methylamino)cyclobut-3-ene-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(methylamino)cyclobut-3-ene-1,2-dione has 2 hydrogen bond donor(s) and 4 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 Bis(methylamino)cyclobut-3-ene-1,2-dione?
The CAS number of Bis(methylamino)cyclobut-3-ene-1,2-dione is 52094-05-0.
What is the molecular formula of Bis(methylamino)cyclobut-3-ene-1,2-dione?
The molecular formula of Bis(methylamino)cyclobut-3-ene-1,2-dione is C6H8N2O2.
What is the molecular weight of Bis(methylamino)cyclobut-3-ene-1,2-dione?
The molecular weight of Bis(methylamino)cyclobut-3-ene-1,2-dione is 140.06 g/mol.
Where can I buy Bis(methylamino)cyclobut-3-ene-1,2-dione?
You can request a quote for Bis(methylamino)cyclobut-3-ene-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(methylamino)cyclobut-3-ene-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for Bis(methylamino)cyclobut-3-ene-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.