1-Methoxyhexan-2-one
TL;DR: 1-Methoxyhexan-2-one (CAS 57134-36-8) is a chemical compound with molecular formula C7H14O2 and molecular weight 130.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxyhexan-2-one
Also Known As: 1-Methoxyhexan-2-one, 1-methoxy-2-hexanone, 2-Hexanone, 1-methoxy-, 1-Methoxy-hexan-2-on, 1-methoxy-hexan-2-one
| Molecular Formula | C7H14O2 |
|---|---|
| Molecular Weight | 130.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 130.09938 |
| Heavy Atoms | 9 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 57134-36-8 |
|---|---|
| SMILES | CCCCC(=O)COC |
| InChIKey | HPVRZSQOEHEUKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methoxyhexan-2-one (CAS 57134-36-8), with molecular formula C7H14O2 and molecular weight 130.10 g/mol. IUPAC: 1-methoxyhexan-2-one.
Chemical Property Profile of 1-Methoxyhexan-2-one
Property Insights of 1-Methoxyhexan-2-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxyhexan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Methoxyhexan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxyhexan-2-one has 0 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 1-Methoxyhexan-2-one?
The CAS number of 1-Methoxyhexan-2-one is 57134-36-8.
What is the molecular formula of 1-Methoxyhexan-2-one?
The molecular formula of 1-Methoxyhexan-2-one is C7H14O2.
What is the molecular weight of 1-Methoxyhexan-2-one?
The molecular weight of 1-Methoxyhexan-2-one is 130.10 g/mol.
Where can I buy 1-Methoxyhexan-2-one?
You can request a quote for 1-Methoxyhexan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxyhexan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxyhexan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.