Cinerin
TL;DR: Cinerin (CAS 25478-53-9) is a chemical compound with molecular formula C20H28O3 and molecular weight 316.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(E)-but-2-enyl]-2-methyl-4-oxocyclopent-2-en-1-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: Cinerin, Cinerine I, CINERIN I, Propane triphosphonate, Cinerin I [BSI:ISO]
| Molecular Formula | C20H28O3 |
|---|---|
| Molecular Weight | 316.20 g/mol |
| LogP | 4.3921 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.20386 |
| Heavy Atoms | 23 |
| Complexity | 600.37634 |
Chemical Identifiers
| CAS Number | 25478-53-9 |
|---|---|
| SMILES | C/C=C/CC1=C(C(CC1=O)OC(=O)C2C(C2(C)C)C=C(C)C)C |
Product Overview
Cinerin (CAS 25478-53-9), with molecular formula C20H28O3 and molecular weight 316.20 g/mol. IUPAC: [3-[(E)-but-2-enyl]-2-methyl-4-oxocyclopent-2-en-1-yl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of Cinerin
Property Insights of Cinerin
The XLogP value of 4.3921 indicates that Cinerin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Cinerin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinerin has 0 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 Cinerin?
The CAS number of Cinerin is 25478-53-9.
What is the molecular formula of Cinerin?
The molecular formula of Cinerin is C20H28O3.
What is the molecular weight of Cinerin?
The molecular weight of Cinerin is 316.20 g/mol.
Where can I buy Cinerin?
You can request a quote for Cinerin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinerin?
Yes, KEHONG BIO provides custom synthesis services for Cinerin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.