1-(4-Methoxyphenoxy)acetone
TL;DR: 1-(4-Methoxyphenoxy)acetone (CAS 6698-71-1) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenoxy)propan-2-one
Also Known As: 1-(4-methoxyphenoxy)acetone, 1-(4-methoxyphenoxy)propan-2-one, 1- -2-propanone, 4-Methoxyphenylacetone, 1-(4-METHOXYPHENOXY)-2-PROPANONE
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 6698-71-1 |
|---|---|
| SMILES | CC(=O)COC1=CC=C(C=C1)OC |
| InChIKey | IVXPKANJKOHDKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Methoxyphenoxy)acetone (CAS 6698-71-1), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 1-(4-methoxyphenoxy)propan-2-one.
Chemical Property Profile of 1-(4-Methoxyphenoxy)acetone
Property Insights of 1-(4-Methoxyphenoxy)acetone
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxyphenoxy)acetone. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(4-Methoxyphenoxy)acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methoxyphenoxy)acetone 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-(4-Methoxyphenoxy)acetone?
The CAS number of 1-(4-Methoxyphenoxy)acetone is 6698-71-1.
What is the molecular formula of 1-(4-Methoxyphenoxy)acetone?
The molecular formula of 1-(4-Methoxyphenoxy)acetone is C10H12O3.
What is the molecular weight of 1-(4-Methoxyphenoxy)acetone?
The molecular weight of 1-(4-Methoxyphenoxy)acetone is 180.08 g/mol.
Where can I buy 1-(4-Methoxyphenoxy)acetone?
You can request a quote for 1-(4-Methoxyphenoxy)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenoxy)acetone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenoxy)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.