2-甲基喹喔啉1,4-二氧化物
TL;DR: 2-甲基喹喔啉1,4-二氧化物 (CAS 6639-86-7) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲基喹喔啉1,4-二氧化物
3-methyl-4-oxidoquinoxalin-1-ium 1-oxide
Also Known As: 2-methylquinoxalinediium-1,4-diolate, 2-Methylquinoxaline 1,4-dioxide, Quinoxaline, 2-methyl-, 1,4-dioxide, Quinoxaline, 1,4-dioxide, 2-Methylquinoxaline-1,4-dioxide
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 46.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 6639-86-7 |
|---|---|
| SMILES | CC1=C[N+](=O)C2=CC=CC=C2N1[O-] |
| InChIKey | PZUHHXFIMAEXGO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-甲基喹喔啉1,4-二氧化物 (CAS 6639-86-7), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 3-methyl-4-oxidoquinoxalin-1-ium 1-oxide.
Chemical Property Profile of 2-甲基喹喔啉1,4-二氧化物
Property Insights of 2-甲基喹喔啉1,4-二氧化物
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-甲基喹喔啉1,4-二氧化物. With a topological polar surface area (TPSA) of 46.4 Ų, 2-甲基喹喔啉1,4-二氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-甲基喹喔啉1,4-二氧化物 has 0 hydrogen bond donor(s) and 3 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 2-甲基喹喔啉1,4-二氧化物?
The CAS number of 2-甲基喹喔啉1,4-二氧化物 is 6639-86-7.
What is the molecular formula of 2-甲基喹喔啉1,4-二氧化物?
The molecular formula of 2-甲基喹喔啉1,4-二氧化物 is C9H8N2O2.
What is the molecular weight of 2-甲基喹喔啉1,4-二氧化物?
The molecular weight of 2-甲基喹喔啉1,4-二氧化物 is 176.06 g/mol.
Where can I buy 2-甲基喹喔啉1,4-二氧化物?
You can request a quote for 2-甲基喹喔啉1,4-二氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲基喹喔啉1,4-二氧化物?
Yes, KEHONG BIO provides custom synthesis services for 2-甲基喹喔啉1,4-二氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.