H-Ile-OEt.HCl
TL;DR: H-Ile-OEt.HCl (CAS 567-56-6) is a chemical compound with molecular formula C8H18ClNO2 and molecular weight 195.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S,3S)-2-amino-3-methylpentanoate;hydrochloride
Also Known As: H-Ile-OEt.HCl, L-isoleucine ethyl Ester hydrochloride, Ethyl L-isoleucinate hydrochloride, L-Isoleucine ethyl ester HCl, Ethyl L-isoleucinate HCl
| Molecular Formula | C8H18ClNO2 |
|---|---|
| Molecular Weight | 195.10 g/mol |
| LogP | 1.3447 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.1026 |
| Heavy Atoms | 12 |
| Complexity | 130.22627 |
Chemical Identifiers
| CAS Number | 567-56-6 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)OCC)N.Cl |
Product Overview
H-Ile-OEt.HCl (CAS 567-56-6), with molecular formula C8H18ClNO2 and molecular weight 195.10 g/mol. IUPAC: ethyl (2S,3S)-2-amino-3-methylpentanoate;hydrochloride.
Chemical Property Profile of H-Ile-OEt.HCl
Property Insights of H-Ile-OEt.HCl
The XLogP value of 1.3447 suggests moderate lipophilicity, balancing water solubility and membrane permeability for H-Ile-OEt.HCl. With a topological polar surface area (TPSA) of 52.32 Ų, H-Ile-OEt.HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, H-Ile-OEt.HCl 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 H-Ile-OEt.HCl?
The CAS number of H-Ile-OEt.HCl is 567-56-6.
What is the molecular formula of H-Ile-OEt.HCl?
The molecular formula of H-Ile-OEt.HCl is C8H18ClNO2.
What is the molecular weight of H-Ile-OEt.HCl?
The molecular weight of H-Ile-OEt.HCl is 195.10 g/mol.
Where can I buy H-Ile-OEt.HCl?
You can request a quote for H-Ile-OEt.HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for H-Ile-OEt.HCl?
Yes, KEHONG BIO provides custom synthesis services for H-Ile-OEt.HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.