5,6-Dimethoxy-3-phenylindan-1-one
TL;DR: 5,6-Dimethoxy-3-phenylindan-1-one (CAS 4087-68-7) is a chemical compound with molecular formula C17H16O3 and molecular weight 268.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethoxy-3-phenyl-2,3-dihydroinden-1-one
Also Known As: 5,6-dimethoxy-3-phenyl-1-indanone, 5,6-dimethoxy-3-phenylindan-1-one, 5,6-dimethoxy-3-phenyl-2,3-dihydro-1H-inden-1-one, 5,6-dimethoxy-3-phenyl-2,3-dihydroinden-1-one, 2,3-Dihydro-5,6-dimethoxy-3-phenyl-1H-inden-1-one
| Molecular Formula | C17H16O3 |
|---|---|
| Molecular Weight | 268.11 g/mol |
| LogP | 3.4221 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.10995 |
| Heavy Atoms | 20 |
| Complexity | 646.7847 |
Chemical Identifiers
| CAS Number | 4087-68-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=O)CC(C2=C1)C3=CC=CC=C3)OC |
Product Overview
5,6-Dimethoxy-3-phenylindan-1-one (CAS 4087-68-7), with molecular formula C17H16O3 and molecular weight 268.11 g/mol. IUPAC: 5,6-dimethoxy-3-phenyl-2,3-dihydroinden-1-one.
Chemical Property Profile of 5,6-Dimethoxy-3-phenylindan-1-one
Property Insights of 5,6-Dimethoxy-3-phenylindan-1-one
The XLogP value of 3.4221 indicates that 5,6-Dimethoxy-3-phenylindan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 5,6-Dimethoxy-3-phenylindan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dimethoxy-3-phenylindan-1-one 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 5,6-Dimethoxy-3-phenylindan-1-one?
The CAS number of 5,6-Dimethoxy-3-phenylindan-1-one is 4087-68-7.
What is the molecular formula of 5,6-Dimethoxy-3-phenylindan-1-one?
The molecular formula of 5,6-Dimethoxy-3-phenylindan-1-one is C17H16O3.
What is the molecular weight of 5,6-Dimethoxy-3-phenylindan-1-one?
The molecular weight of 5,6-Dimethoxy-3-phenylindan-1-one is 268.11 g/mol.
Where can I buy 5,6-Dimethoxy-3-phenylindan-1-one?
You can request a quote for 5,6-Dimethoxy-3-phenylindan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dimethoxy-3-phenylindan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dimethoxy-3-phenylindan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.