4,5-Dimethoxy-1-indanone
TL;DR: 4,5-Dimethoxy-1-indanone (CAS 7229-50-7) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-2,3-dihydroinden-1-one
Also Known As: 4,5-dimethoxy-1-indanone, 4,5-Dimethoxy-2,3-dihydro-1H-inden-1-one, 4,5-dimethoxyindan-1-one, 4,5-dimethoxy-2,3-dihydroinden-1-one, zlchem 987
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 7229-50-7 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C(=O)CC2)OC |
| InChIKey | XQODIRIVQXQUFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dimethoxy-1-indanone (CAS 7229-50-7), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 4,5-dimethoxy-2,3-dihydroinden-1-one.
Chemical Property Profile of 4,5-Dimethoxy-1-indanone
Property Insights of 4,5-Dimethoxy-1-indanone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dimethoxy-1-indanone. With a topological polar surface area (TPSA) of 35.5 Ų, 4,5-Dimethoxy-1-indanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dimethoxy-1-indanone 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 4,5-Dimethoxy-1-indanone?
The CAS number of 4,5-Dimethoxy-1-indanone is 7229-50-7.
What is the molecular formula of 4,5-Dimethoxy-1-indanone?
The molecular formula of 4,5-Dimethoxy-1-indanone is C11H12O3.
What is the molecular weight of 4,5-Dimethoxy-1-indanone?
The molecular weight of 4,5-Dimethoxy-1-indanone is 192.08 g/mol.
Where can I buy 4,5-Dimethoxy-1-indanone?
You can request a quote for 4,5-Dimethoxy-1-indanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethoxy-1-indanone?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethoxy-1-indanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.