1,5-Dimethoxy-3-pentanone
TL;DR: 1,5-Dimethoxy-3-pentanone (CAS 53005-18-8) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethoxypentan-3-one
Also Known As: 1,5-dimethoxypentan-3-one, 1,5-Dimethoxy-3-pentanone, 3-Pentanone, 1,5-dimethoxy-, 1,5-dimethoxy-pentan-3-one, RefChem:221303
| Molecular Formula | C7H14O3 |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 146.0943 |
| Heavy Atoms | 10 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 53005-18-8 |
|---|---|
| SMILES | COCCC(=O)CCOC |
| InChIKey | KPAJOFKZGBPVJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5-Dimethoxy-3-pentanone (CAS 53005-18-8), with molecular formula C7H14O3 and molecular weight 146.09 g/mol. IUPAC: 1,5-dimethoxypentan-3-one.
Chemical Property Profile of 1,5-Dimethoxy-3-pentanone
Property Insights of 1,5-Dimethoxy-3-pentanone
The XLogP value of -0.5 indicates that 1,5-Dimethoxy-3-pentanone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.5 Ų, 1,5-Dimethoxy-3-pentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dimethoxy-3-pentanone has 0 hydrogen bond donor(s) and 3 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 1,5-Dimethoxy-3-pentanone?
The CAS number of 1,5-Dimethoxy-3-pentanone is 53005-18-8.
What is the molecular formula of 1,5-Dimethoxy-3-pentanone?
The molecular formula of 1,5-Dimethoxy-3-pentanone is C7H14O3.
What is the molecular weight of 1,5-Dimethoxy-3-pentanone?
The molecular weight of 1,5-Dimethoxy-3-pentanone is 146.09 g/mol.
Where can I buy 1,5-Dimethoxy-3-pentanone?
You can request a quote for 1,5-Dimethoxy-3-pentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dimethoxy-3-pentanone?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dimethoxy-3-pentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.