(2S)-2-ethylhexanal
TL;DR: (2S)-2-ethylhexanal (CAS 58712-09-7) is a chemical compound with molecular formula C8H16O and molecular weight 128.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-ethylhexanal
Also Known As: (2S)-2-ethylhexanal, 2-Ethylhexanal, 2-ethyl-hexanal, Hexanal, 2-ethyl-, (S)-, 2-hydroperoxy-13,23-hexaoxidan-1-one
| Molecular Formula | C8H16O |
|---|---|
| Molecular Weight | 128.12 g/mol |
| LogP | 2.4017 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 128.12012 |
| Heavy Atoms | 9 |
| Complexity | 68.96789 |
Chemical Identifiers
| CAS Number | 58712-09-7 |
|---|---|
| SMILES | CCCC[C@H](CC)C=O |
Product Overview
(2S)-2-ethylhexanal (CAS 58712-09-7), with molecular formula C8H16O and molecular weight 128.12 g/mol. IUPAC: (2S)-2-ethylhexanal.
Chemical Property Profile of (2S)-2-ethylhexanal
Property Insights of (2S)-2-ethylhexanal
The XLogP value of 2.4017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-ethylhexanal. With a topological polar surface area (TPSA) of 17.07 Ų, (2S)-2-ethylhexanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-2-ethylhexanal 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 (2S)-2-ethylhexanal?
The CAS number of (2S)-2-ethylhexanal is 58712-09-7.
What is the molecular formula of (2S)-2-ethylhexanal?
The molecular formula of (2S)-2-ethylhexanal is C8H16O.
What is the molecular weight of (2S)-2-ethylhexanal?
The molecular weight of (2S)-2-ethylhexanal is 128.12 g/mol.
Where can I buy (2S)-2-ethylhexanal?
You can request a quote for (2S)-2-ethylhexanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-ethylhexanal?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-ethylhexanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.