N-甲基丁-1-亚胺氧化物
TL;DR: N-甲基丁-1-亚胺氧化物 (CAS 44603-43-2) is a chemical compound with molecular formula C5H11NO and molecular weight 101.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-甲基丁-1-亚胺氧化物
N-methylbutan-1-imine oxide
Also Known As: Methanamine, N-butylidene-, N-oxide
| Molecular Formula | C5H11NO |
|---|---|
| Molecular Weight | 101.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 101.08406 |
| Heavy Atoms | 7 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 44603-43-2 |
|---|---|
| SMILES | CCCC=[N+](C)[O-] |
| InChIKey | YWCNDGABFKKCGI-UHFFFAOYSA-N |
Product Overview
N-甲基丁-1-亚胺氧化物 (CAS 44603-43-2), with molecular formula C5H11NO and molecular weight 101.08 g/mol. IUPAC: N-methylbutan-1-imine oxide.
Chemical Property Profile of N-甲基丁-1-亚胺氧化物
Property Insights of N-甲基丁-1-亚胺氧化物
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-甲基丁-1-亚胺氧化物. With a topological polar surface area (TPSA) of 28.8 Ų, N-甲基丁-1-亚胺氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-甲基丁-1-亚胺氧化物 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 N-甲基丁-1-亚胺氧化物?
The CAS number of N-甲基丁-1-亚胺氧化物 is 44603-43-2.
What is the molecular formula of N-甲基丁-1-亚胺氧化物?
The molecular formula of N-甲基丁-1-亚胺氧化物 is C5H11NO.
What is the molecular weight of N-甲基丁-1-亚胺氧化物?
The molecular weight of N-甲基丁-1-亚胺氧化物 is 101.08 g/mol.
Where can I buy N-甲基丁-1-亚胺氧化物?
You can request a quote for N-甲基丁-1-亚胺氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-甲基丁-1-亚胺氧化物?
Yes, KEHONG BIO provides custom synthesis services for N-甲基丁-1-亚胺氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.