3',4',5'-Trimethoxyacetophenone
TL;DR: 3',4',5'-Trimethoxyacetophenone (CAS 1136-86-3) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4,5-trimethoxyphenyl)ethanone
Also Known As: 3',4',5'-Trimethoxyacetophenone, 1-(3,4,5-TRIMETHOXYPHENYL)ETHANONE, 3,4,5-Trimethoxyacetophenone, Ethanone, 1-(3,4,5-trimethoxyphenyl)-, 1-(3,4,5-trimethoxyphenyl)ethan-1-one
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 1136-86-3 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C(=C1)OC)OC)OC |
| InChIKey | VUGQIIQFXCXZJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3',4',5'-Trimethoxyacetophenone (CAS 1136-86-3), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 1-(3,4,5-trimethoxyphenyl)ethanone.
Chemical Property Profile of 3',4',5'-Trimethoxyacetophenone
Property Insights of 3',4',5'-Trimethoxyacetophenone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',4',5'-Trimethoxyacetophenone. With a topological polar surface area (TPSA) of 44.8 Ų, 3',4',5'-Trimethoxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3',4',5'-Trimethoxyacetophenone has 0 hydrogen bond donor(s) and 4 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',4',5'-Trimethoxyacetophenone?
The CAS number of 3',4',5'-Trimethoxyacetophenone is 1136-86-3.
What is the molecular formula of 3',4',5'-Trimethoxyacetophenone?
The molecular formula of 3',4',5'-Trimethoxyacetophenone is C11H14O4.
What is the molecular weight of 3',4',5'-Trimethoxyacetophenone?
The molecular weight of 3',4',5'-Trimethoxyacetophenone is 210.09 g/mol.
Where can I buy 3',4',5'-Trimethoxyacetophenone?
You can request a quote for 3',4',5'-Trimethoxyacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4',5'-Trimethoxyacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 3',4',5'-Trimethoxyacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.