2-Ethyl-3-hydroxyhexanal
TL;DR: 2-Ethyl-3-hydroxyhexanal (CAS 496-03-7) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-3-hydroxyhexanal
Also Known As: Butyraldol, 2-ETHYL-3-HYDROXYHEXANAL, Butylaldol, 3-Hydroxy-2-ethylhexanal, Hexanal,2-ethyl-3-hydroxy-
| Molecular Formula | C8H16O2 |
|---|---|
| Molecular Weight | 144.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 144.11504 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 496-03-7 |
|---|---|
| SMILES | CCCC(C(CC)C=O)O |
| InChIKey | FMBAIQMSJGQWLF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethyl-3-hydroxyhexanal (CAS 496-03-7), with molecular formula C8H16O2 and molecular weight 144.12 g/mol. IUPAC: 2-ethyl-3-hydroxyhexanal.
Chemical Property Profile of 2-Ethyl-3-hydroxyhexanal
Property Insights of 2-Ethyl-3-hydroxyhexanal
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-3-hydroxyhexanal. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Ethyl-3-hydroxyhexanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-3-hydroxyhexanal has 1 hydrogen bond donor(s) and 2 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 2-Ethyl-3-hydroxyhexanal?
The CAS number of 2-Ethyl-3-hydroxyhexanal is 496-03-7.
What is the molecular formula of 2-Ethyl-3-hydroxyhexanal?
The molecular formula of 2-Ethyl-3-hydroxyhexanal is C8H16O2.
What is the molecular weight of 2-Ethyl-3-hydroxyhexanal?
The molecular weight of 2-Ethyl-3-hydroxyhexanal is 144.12 g/mol.
Where can I buy 2-Ethyl-3-hydroxyhexanal?
You can request a quote for 2-Ethyl-3-hydroxyhexanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-3-hydroxyhexanal?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-3-hydroxyhexanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.