trans-Quinoline-5,6,7,8-dioxide
TL;DR: trans-Quinoline-5,6,7,8-dioxide (CAS 142129-81-5) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.04768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R)-3,6-dioxa-9-azatetracyclo[6.4.0.02,4.05,7]dodeca-1(8),9,11-triene
Also Known As: Fluoromoxestrol, trans-Quinoline-5,6,7,8-dioxide, 1a,1b,2a,6b-Tetrahydrobisoxireno[f,h]quinoline, (+-)-trans-5,6,7,8-Diepoxy-5,6,7,8-tetrahydroquinoline, (1aR,6bS)-1a,1b,2a,6b-tetrahydrobisoxireno[f,h]quinoline
Technical Specifications
| Molecular Formula | C9H7NO2 |
| Molecular Weight | 161.04768 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 38.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.04768 Da |
| Heavy Atoms | 12 |
| Complexity | 233.0 |
| SMILES | C1=CC2=C(C3C(O3)[C@H]4[C@H]2O4)N=C1 |
| InChIKey | DLTXKFCMJDWKEV-YRXIUSAGSA-N |
Chemical Property Profile of trans-Quinoline-5,6,7,8-dioxide
Property Insights of trans-Quinoline-5,6,7,8-dioxide
The XLogP value of -0.3 indicates that trans-Quinoline-5,6,7,8-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.0 Ų, trans-Quinoline-5,6,7,8-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-Quinoline-5,6,7,8-dioxide 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
What is the CAS number of trans-Quinoline-5,6,7,8-dioxide?
The CAS number of trans-Quinoline-5,6,7,8-dioxide is 142129-81-5.
What is the molecular formula of trans-Quinoline-5,6,7,8-dioxide?
The molecular formula of trans-Quinoline-5,6,7,8-dioxide is C9H7NO2.
What is the molecular weight of trans-Quinoline-5,6,7,8-dioxide?
The molecular weight of trans-Quinoline-5,6,7,8-dioxide is 161.04768 g/mol.
Where can I buy trans-Quinoline-5,6,7,8-dioxide?
You can request a quote for trans-Quinoline-5,6,7,8-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for trans-Quinoline-5,6,7,8-dioxide?
Yes, CoreyChem provides custom synthesis services for trans-Quinoline-5,6,7,8-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.