4-Benzoyl-1-indancarboxylic acid
TL;DR: 4-Benzoyl-1-indancarboxylic acid (CAS 6345-74-0) is a chemical compound with molecular formula C17H14O3 and molecular weight 266.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzoyl-2,3-dihydro-1H-indene-1-carboxylic acid
Also Known As: 4-Benzoyl-1-indancarboxylic acid, 4-benzoyl-1-indancarboxylicacid, 4-Benzoyl-1-indancarbonsaeure, 4-benzoylindane-1-carboxylic acid, 1-Indancarboxylic acid, 4-benzoyl-
| Molecular Formula | C17H14O3 |
|---|---|
| Molecular Weight | 266.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.0943 |
| Heavy Atoms | 20 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 6345-74-0 |
|---|---|
| SMILES | C1CC2=C(C1C(=O)O)C=CC=C2C(=O)C3=CC=CC=C3 |
| InChIKey | FXUBHWHRMVGJOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Benzoyl-1-indancarboxylic acid (CAS 6345-74-0), with molecular formula C17H14O3 and molecular weight 266.09 g/mol. IUPAC: 4-benzoyl-2,3-dihydro-1H-indene-1-carboxylic acid.
Chemical Property Profile of 4-Benzoyl-1-indancarboxylic acid
Property Insights of 4-Benzoyl-1-indancarboxylic acid
The XLogP value of 3.2 indicates that 4-Benzoyl-1-indancarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 4-Benzoyl-1-indancarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzoyl-1-indancarboxylic acid has 1 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-Benzoyl-1-indancarboxylic acid?
The CAS number of 4-Benzoyl-1-indancarboxylic acid is 6345-74-0.
What is the molecular formula of 4-Benzoyl-1-indancarboxylic acid?
The molecular formula of 4-Benzoyl-1-indancarboxylic acid is C17H14O3.
What is the molecular weight of 4-Benzoyl-1-indancarboxylic acid?
The molecular weight of 4-Benzoyl-1-indancarboxylic acid is 266.09 g/mol.
Where can I buy 4-Benzoyl-1-indancarboxylic acid?
You can request a quote for 4-Benzoyl-1-indancarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzoyl-1-indancarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzoyl-1-indancarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.