(5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid
TL;DR: (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid (CAS 42882-19-9) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-oxo-2-phenylcyclopenten-1-yl)acetic acid
Also Known As: (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid, -ACETICACID, Ethyl chlorofluoroacetate, ChemDiv2_000303, (5-oxo-2-phenylcyclopent-1-en-1-yl)acetic acid
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 42882-19-9 |
|---|---|
| SMILES | C1CC(=O)C(=C1C2=CC=CC=C2)CC(=O)O |
| InChIKey | GMVRVPYITUYSHB-UHFFFAOYSA-N |
Product Overview
(5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid (CAS 42882-19-9), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: 2-(5-oxo-2-phenylcyclopenten-1-yl)acetic acid.
Chemical Property Profile of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid
Property Insights of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid. With a topological polar surface area (TPSA) of 54.4 Ų, (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic 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 (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid?
The CAS number of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid is 42882-19-9.
What is the molecular formula of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid?
The molecular formula of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid is C13H12O3.
What is the molecular weight of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid?
The molecular weight of (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid is 216.08 g/mol.
Where can I buy (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid?
You can request a quote for (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (5-Oxo-2-phenyl-cyclopent-1-enyl)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.