1,2-Cyclopentanedione, 3-phenyl-
TL;DR: 1,2-Cyclopentanedione, 3-phenyl- (CAS 69745-71-7) is a chemical compound with molecular formula C11H10O2 and molecular weight 174.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylcyclopentane-1,2-dione
Also Known As: 3-phenylcyclopentane-1,2-dione, 1,2-Cyclopentanedione, 3-phenyl-, 3-Phenyl-1,2-cyclopentanedione, 3-phenyl-cyclopentane-1,2-dione, 3-Phenyl-1,2-cyclopentanedione #
| Molecular Formula | C11H10O2 |
|---|---|
| Molecular Weight | 174.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.06808 |
| Heavy Atoms | 13 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 69745-71-7 |
|---|---|
| SMILES | C1CC(=O)C(=O)C1C2=CC=CC=C2 |
| InChIKey | PLQPJDWMIRZCOH-UHFFFAOYSA-N |
Product Overview
1,2-Cyclopentanedione, 3-phenyl- (CAS 69745-71-7), with molecular formula C11H10O2 and molecular weight 174.07 g/mol. IUPAC: 3-phenylcyclopentane-1,2-dione.
Chemical Property Profile of 1,2-Cyclopentanedione, 3-phenyl-
Property Insights of 1,2-Cyclopentanedione, 3-phenyl-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Cyclopentanedione, 3-phenyl-. With a topological polar surface area (TPSA) of 34.1 Ų, 1,2-Cyclopentanedione, 3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclopentanedione, 3-phenyl- has 0 hydrogen bond donor(s) and 2 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 1,2-Cyclopentanedione, 3-phenyl-?
The CAS number of 1,2-Cyclopentanedione, 3-phenyl- is 69745-71-7.
What is the molecular formula of 1,2-Cyclopentanedione, 3-phenyl-?
The molecular formula of 1,2-Cyclopentanedione, 3-phenyl- is C11H10O2.
What is the molecular weight of 1,2-Cyclopentanedione, 3-phenyl-?
The molecular weight of 1,2-Cyclopentanedione, 3-phenyl- is 174.07 g/mol.
Where can I buy 1,2-Cyclopentanedione, 3-phenyl-?
You can request a quote for 1,2-Cyclopentanedione, 3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclopentanedione, 3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclopentanedione, 3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.