三乙胺氧化物
TL;DR: 三乙胺氧化物 (CAS 2687-45-8) is a chemical compound with molecular formula C6H15NO and molecular weight 117.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三乙胺氧化物
N,N-diethylethanamine oxide
Also Known As: Triethylamine N-oxide, N,N-diethylethanamine oxide, triethylamine oxide, Triethylamine-N-oxide, Ethanamine, N,N-diethyl-, N-oxide
| Molecular Formula | C6H15NO |
|---|---|
| Molecular Weight | 117.12 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 117.115364 |
| Heavy Atoms | 8 |
| Complexity | 51.0 |
Chemical Identifiers
| CAS Number | 2687-45-8 |
|---|---|
| SMILES | CC[N+](CC)(CC)[O-] |
| InChIKey | LFMTUFVYMCDPGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三乙胺氧化物 (CAS 2687-45-8), with molecular formula C6H15NO and molecular weight 117.12 g/mol. IUPAC: N,N-diethylethanamine oxide.
Chemical Property Profile of 三乙胺氧化物
Property Insights of 三乙胺氧化物
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三乙胺氧化物. With a topological polar surface area (TPSA) of 18.1 Ų, 三乙胺氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三乙胺氧化物 has 0 hydrogen bond donor(s) and 1 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 三乙胺氧化物?
The CAS number of 三乙胺氧化物 is 2687-45-8.
What is the molecular formula of 三乙胺氧化物?
The molecular formula of 三乙胺氧化物 is C6H15NO.
What is the molecular weight of 三乙胺氧化物?
The molecular weight of 三乙胺氧化物 is 117.12 g/mol.
Where can I buy 三乙胺氧化物?
You can request a quote for 三乙胺氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三乙胺氧化物?
Yes, KEHONG BIO provides custom synthesis services for 三乙胺氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.