Cinatrin C1
TL;DR: Cinatrin C1 (CAS 136266-35-8) is a chemical compound with molecular formula C18H30O8 and molecular weight 374.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4R)-2-dodecoxycarbonyl-4-hydroxy-5-oxooxolane-3-carboperoxoic acid
Also Known As: Cinatrin C1, (2S,3R,4R)-2-dodecoxycarbonyl-4-hydroxy-5-oxooxolane-3-carboperoxoic acid, 2,3-Furandicarboxylic acid, 2-dodecyltetrahydro-3,4-dihydroxy-5-oxo-, (2S-(2alpha,3alpha,4beta))-, 2-dodecoxycarbonyl-4-hydroxy-5-oxooxolane-3-carboperoxoic acid, (2S,3R,4R)-2-[(DODECYLOXY)CARBONYL]-4-HYDROXY-5-OXOOXOLANE-3-CARBOPEROXOIC ACID
| Molecular Formula | C18H30O8 |
|---|---|
| Molecular Weight | 374.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 374.19406 |
| Heavy Atoms | 26 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 136266-35-8 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)[C@@H]1[C@@H]([C@H](C(=O)O1)O)C(=O)OO |
| InChIKey | YYAODTFONAOLHT-KFWWJZLASA-N |
Product Overview
Cinatrin C1 (CAS 136266-35-8), with molecular formula C18H30O8 and molecular weight 374.19 g/mol. IUPAC: (2S,3R,4R)-2-dodecoxycarbonyl-4-hydroxy-5-oxooxolane-3-carboperoxoic acid.
Chemical Property Profile of Cinatrin C1
Property Insights of Cinatrin C1
The XLogP value of 4.7 indicates that Cinatrin C1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cinatrin C1. Following Lipinski's Rule of Five, Cinatrin C1 has 2 hydrogen bond donor(s) and 8 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 Cinatrin C1?
The CAS number of Cinatrin C1 is 136266-35-8.
What is the molecular formula of Cinatrin C1?
The molecular formula of Cinatrin C1 is C18H30O8.
What is the molecular weight of Cinatrin C1?
The molecular weight of Cinatrin C1 is 374.19 g/mol.
Where can I buy Cinatrin C1?
You can request a quote for Cinatrin C1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinatrin C1?
Yes, KEHONG BIO provides custom synthesis services for Cinatrin C1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.