L-Isoleucine, ethyl ester
TL;DR: L-Isoleucine, ethyl ester (CAS 55056-62-7) is a chemical compound with molecular formula C8H17NO2 and molecular weight 159.13 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
Also Known As: Ethyl L-isoleucinate, L-Isoleucine ethyl ester, L-Isoleucine, ethyl ester, Isoleucine, ethyl ester, L-, Isoleucine ethyl ester
| Molecular Formula | C8H17NO2 |
|---|---|
| Molecular Weight | 159.13 g/mol |
| LogP | 0.9229 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 159.12593 |
| Heavy Atoms | 11 |
| Complexity | 125.26047 |
Chemical Identifiers
| CAS Number | 55056-62-7 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)OCC)N |
Product Overview
L-Isoleucine, ethyl ester (CAS 55056-62-7), with molecular formula C8H17NO2 and molecular weight 159.13 g/mol. IUPAC: ethyl (2S,3S)-2-amino-3-methylpentanoate.
Chemical Property Profile of L-Isoleucine, ethyl ester
Property Insights of L-Isoleucine, ethyl ester
The XLogP value of 0.9229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Isoleucine, ethyl ester. With a topological polar surface area (TPSA) of 52.32 Ų, L-Isoleucine, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, L-Isoleucine, ethyl ester 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 L-Isoleucine, ethyl ester?
The CAS number of L-Isoleucine, ethyl ester is 55056-62-7.
What is the molecular formula of L-Isoleucine, ethyl ester?
The molecular formula of L-Isoleucine, ethyl ester is C8H17NO2.
What is the molecular weight of L-Isoleucine, ethyl ester?
The molecular weight of L-Isoleucine, ethyl ester is 159.13 g/mol.
Where can I buy L-Isoleucine, ethyl ester?
You can request a quote for L-Isoleucine, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Isoleucine, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for L-Isoleucine, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.