2-Heptanone, 5-ethyl-
TL;DR: 2-Heptanone, 5-ethyl- (CAS 40238-93-5) is a chemical compound with molecular formula C9H18O and molecular weight 142.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethylheptan-2-one
Also Known As: 5-ethylheptan-2-one, 2-Heptanone, 5-ethyl-, 3-ethyl-6-heptanone, 5-Ethyl-2-heptanone, 5-ethyl-heptan-2-one
| Molecular Formula | C9H18O |
|---|---|
| Molecular Weight | 142.14 g/mol |
| LogP | 2.7918 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 142.13577 |
| Heavy Atoms | 10 |
| Complexity | 92.90139 |
Chemical Identifiers
| CAS Number | 40238-93-5 |
|---|---|
| SMILES | CCC(CC)CCC(=O)C |
Product Overview
2-Heptanone, 5-ethyl- (CAS 40238-93-5), with molecular formula C9H18O and molecular weight 142.14 g/mol. IUPAC: 5-ethylheptan-2-one.
Chemical Property Profile of 2-Heptanone, 5-ethyl-
Property Insights of 2-Heptanone, 5-ethyl-
The XLogP value of 2.7918 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Heptanone, 5-ethyl-. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Heptanone, 5-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptanone, 5-ethyl- 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 2-Heptanone, 5-ethyl-?
The CAS number of 2-Heptanone, 5-ethyl- is 40238-93-5.
What is the molecular formula of 2-Heptanone, 5-ethyl-?
The molecular formula of 2-Heptanone, 5-ethyl- is C9H18O.
What is the molecular weight of 2-Heptanone, 5-ethyl-?
The molecular weight of 2-Heptanone, 5-ethyl- is 142.14 g/mol.
Where can I buy 2-Heptanone, 5-ethyl-?
You can request a quote for 2-Heptanone, 5-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Heptanone, 5-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Heptanone, 5-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.