(3,5-Dimethoxyphenyl)acetone
TL;DR: (3,5-Dimethoxyphenyl)acetone (CAS 18917-77-6) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethoxyphenyl)propan-2-one
Also Known As: 1-(3,5-dimethoxyphenyl)propan-2-one, 3-Bromothiobenzamide, (3,5-DIMETHOXYPHENYL)ACETONE, 1-(3,5-Dimethoxyphenyl)acetone, 3,5-Dimethoxybenzylmethyl ketone
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 18917-77-6 |
|---|---|
| SMILES | CC(=O)CC1=CC(=CC(=C1)OC)OC |
| InChIKey | BKWQFIARUMVMFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,5-Dimethoxyphenyl)acetone (CAS 18917-77-6), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: 1-(3,5-dimethoxyphenyl)propan-2-one.
Chemical Property Profile of (3,5-Dimethoxyphenyl)acetone
Property Insights of (3,5-Dimethoxyphenyl)acetone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-Dimethoxyphenyl)acetone. With a topological polar surface area (TPSA) of 35.5 Ų, (3,5-Dimethoxyphenyl)acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,5-Dimethoxyphenyl)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 (3,5-Dimethoxyphenyl)acetone?
The CAS number of (3,5-Dimethoxyphenyl)acetone is 18917-77-6.
What is the molecular formula of (3,5-Dimethoxyphenyl)acetone?
The molecular formula of (3,5-Dimethoxyphenyl)acetone is C11H14O3.
What is the molecular weight of (3,5-Dimethoxyphenyl)acetone?
The molecular weight of (3,5-Dimethoxyphenyl)acetone is 194.09 g/mol.
Where can I buy (3,5-Dimethoxyphenyl)acetone?
You can request a quote for (3,5-Dimethoxyphenyl)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-Dimethoxyphenyl)acetone?
Yes, KEHONG BIO provides custom synthesis services for (3,5-Dimethoxyphenyl)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.