N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物
TL;DR: N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 (CAS 86544-59-4) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物
N-(3-ethoxy-3-oxopropyl)-1-phenylmethanimine oxide
Also Known As: N-(3-ethoxy-3-oxopropyl)-1-phenylmethanimine oxide, BENZYLIDENE-(2-ETHOXYCARBONYLETHYL)-OXIDO-AZANIUM
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 86544-59-4 |
|---|---|
| SMILES | CCOC(=O)CC[N+](=CC1=CC=CC=C1)[O-] |
| InChIKey | YVMIJWQGWCNHKP-UHFFFAOYSA-N |
Product Overview
N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 (CAS 86544-59-4), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: N-(3-ethoxy-3-oxopropyl)-1-phenylmethanimine oxide.
Chemical Property Profile of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物
Property Insights of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物. With a topological polar surface area (TPSA) of 55.1 Ų, N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 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 N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物?
The CAS number of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 is 86544-59-4.
What is the molecular formula of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物?
The molecular formula of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 is C12H15NO3.
What is the molecular weight of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物?
The molecular weight of N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 is 221.11 g/mol.
Where can I buy N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物?
You can request a quote for N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物?
Yes, KEHONG BIO provides custom synthesis services for N-(3-乙氧基-3-氧代丙基)-1-苯基甲亚胺氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.