methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate
TL;DR: methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate (CAS 29673-32-3) is a chemical compound with molecular formula C19H37NO2 and molecular weight 311.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate
Also Known As: J2.006.625C, methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate, 3alpha-Octylaziridine-2alpha-octanoic acid methyl ester
| Molecular Formula | C19H37NO2 |
|---|---|
| Molecular Weight | 311.28 g/mol |
| LogP | 4.9811 |
| Topological Polar Surface Area | 48.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 311.28244 |
| Heavy Atoms | 22 |
| Complexity | 280.60873 |
Chemical Identifiers
| CAS Number | 29673-32-3 |
|---|---|
| SMILES | CCCCCCCC[C@H]1[C@H](N1)CCCCCCCC(=O)OC |
Product Overview
methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate (CAS 29673-32-3), with molecular formula C19H37NO2 and molecular weight 311.28 g/mol. IUPAC: methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate.
Chemical Property Profile of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate
Property Insights of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate
The XLogP value of 4.9811 indicates that methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.24 Ų, methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate has 1 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 methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate?
The CAS number of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate is 29673-32-3.
What is the molecular formula of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate?
The molecular formula of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate is C19H37NO2.
What is the molecular weight of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate?
The molecular weight of methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate is 311.28 g/mol.
Where can I buy methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate?
You can request a quote for methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 8-[(2R,3S)-3-octylaziridin-2-yl]octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.