(2-Oxo-1-phenylcyclopentyl)acetic acid
TL;DR: (2-Oxo-1-phenylcyclopentyl)acetic acid (CAS 3645-87-2) is a chemical compound with molecular formula C13H14O3 and molecular weight 218.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxo-1-phenylcyclopentyl)acetic acid
Also Known As: 2-Oxo-1-phenylcyclopentaneacetic acid, 2-(2-oxo-1-phenylcyclopentyl)acetic acid, Cyclopentaneacetic acid, 2-oxo-1-phenyl-, (2-Oxo-1-phenylcyclopentyl)acetic acid, <1-Phenyl-2-oxo-cyclopentyl>-essigsaeure
| Molecular Formula | C13H14O3 |
|---|---|
| Molecular Weight | 218.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.0943 |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 3645-87-2 |
|---|---|
| SMILES | C1CC(=O)C(C1)(CC(=O)O)C2=CC=CC=C2 |
| InChIKey | NRSOFNZPFPBHBU-UHFFFAOYSA-N |
Product Overview
(2-Oxo-1-phenylcyclopentyl)acetic acid (CAS 3645-87-2), with molecular formula C13H14O3 and molecular weight 218.09 g/mol. IUPAC: 2-(2-oxo-1-phenylcyclopentyl)acetic acid.
Chemical Property Profile of (2-Oxo-1-phenylcyclopentyl)acetic acid
Property Insights of (2-Oxo-1-phenylcyclopentyl)acetic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Oxo-1-phenylcyclopentyl)acetic acid. With a topological polar surface area (TPSA) of 54.4 Ų, (2-Oxo-1-phenylcyclopentyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Oxo-1-phenylcyclopentyl)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 (2-Oxo-1-phenylcyclopentyl)acetic acid?
The CAS number of (2-Oxo-1-phenylcyclopentyl)acetic acid is 3645-87-2.
What is the molecular formula of (2-Oxo-1-phenylcyclopentyl)acetic acid?
The molecular formula of (2-Oxo-1-phenylcyclopentyl)acetic acid is C13H14O3.
What is the molecular weight of (2-Oxo-1-phenylcyclopentyl)acetic acid?
The molecular weight of (2-Oxo-1-phenylcyclopentyl)acetic acid is 218.09 g/mol.
Where can I buy (2-Oxo-1-phenylcyclopentyl)acetic acid?
You can request a quote for (2-Oxo-1-phenylcyclopentyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxo-1-phenylcyclopentyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxo-1-phenylcyclopentyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.