7-Methyl-4-oxo-octanoic acid
TL;DR: 7-Methyl-4-oxo-octanoic acid (CAS 75253-72-4) is a chemical compound with molecular formula C9H16O3 and molecular weight 172.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-4-oxooctanoic acid
Also Known As: 7-methyl-4-oxooctanoic acid, 7-methyl-4-oxo-octanoic acid
| Molecular Formula | C9H16O3 |
|---|---|
| Molecular Weight | 172.11 g/mol |
| LogP | 1.8565 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 172.10994 |
| Heavy Atoms | 12 |
| Complexity | 161.15659 |
Chemical Identifiers
| CAS Number | 75253-72-4 |
|---|---|
| SMILES | CC(C)CCC(=O)CCC(=O)O |
Product Overview
7-Methyl-4-oxo-octanoic acid (CAS 75253-72-4), with molecular formula C9H16O3 and molecular weight 172.11 g/mol. IUPAC: 7-methyl-4-oxooctanoic acid.
Chemical Property Profile of 7-Methyl-4-oxo-octanoic acid
Property Insights of 7-Methyl-4-oxo-octanoic acid
The XLogP value of 1.8565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methyl-4-oxo-octanoic acid. With a topological polar surface area (TPSA) of 54.37 Ų, 7-Methyl-4-oxo-octanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methyl-4-oxo-octanoic acid 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 7-Methyl-4-oxo-octanoic acid?
The CAS number of 7-Methyl-4-oxo-octanoic acid is 75253-72-4.
What is the molecular formula of 7-Methyl-4-oxo-octanoic acid?
The molecular formula of 7-Methyl-4-oxo-octanoic acid is C9H16O3.
What is the molecular weight of 7-Methyl-4-oxo-octanoic acid?
The molecular weight of 7-Methyl-4-oxo-octanoic acid is 172.11 g/mol.
Where can I buy 7-Methyl-4-oxo-octanoic acid?
You can request a quote for 7-Methyl-4-oxo-octanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methyl-4-oxo-octanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-Methyl-4-oxo-octanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.