3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid
TL;DR: 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid (CAS 27932-00-9) is a chemical compound with molecular formula C18H16O4 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3-dihydro-1H-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid
Also Known As: hydrogenphenylmalonate, starbld0023036, 5-Indanol Hydrogen Phenylmalonate, 3-(2,3-dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid, Phenylmalonic Acid Mono-5-indanyl Ester
| Molecular Formula | C18H16O4 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.10486 |
| Heavy Atoms | 22 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 27932-00-9 |
|---|---|
| SMILES | C1CC2=C(C1)C=C(C=C2)OC(=O)C(C3=CC=CC=C3)C(=O)O |
| InChIKey | ZPIUANRTQSWZBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid (CAS 27932-00-9), with molecular formula C18H16O4 and molecular weight 296.10 g/mol. IUPAC: 3-(2,3-dihydro-1H-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid.
Chemical Property Profile of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid
Property Insights of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid
The XLogP value of 3.9 indicates that 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid. Following Lipinski's Rule of Five, 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid has 1 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-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid?
The CAS number of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid is 27932-00-9.
What is the molecular formula of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid?
The molecular formula of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid is C18H16O4.
What is the molecular weight of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid?
The molecular weight of 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid is 296.10 g/mol.
Where can I buy 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid?
You can request a quote for 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3-Dihydro-1h-inden-5-yloxy)-3-oxo-2-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.