Cyclopentanefumaric acid
TL;DR: Cyclopentanefumaric acid (CAS 5469-39-6) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyclopentylbut-2-enedioic acid
Also Known As: Cyclopentanefumaric acid, 2-cyclopentylfumaric acid, (E)-2-cyclopentylbut-2-enedioic acid, (2E)-2-Cyclopentylbut-2-enedioic acid, RefChem:335977
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 1.2722 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 248.34032 |
Chemical Identifiers
| CAS Number | 5469-39-6 |
|---|---|
| SMILES | C1CCC(C1)/C(=C\C(=O)O)/C(=O)O |
Product Overview
Cyclopentanefumaric acid (CAS 5469-39-6), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: (E)-2-cyclopentylbut-2-enedioic acid.
Chemical Property Profile of Cyclopentanefumaric acid
Property Insights of Cyclopentanefumaric acid
The XLogP value of 1.2722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentanefumaric acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopentanefumaric acid. Following Lipinski's Rule of Five, Cyclopentanefumaric acid has 2 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 Cyclopentanefumaric acid?
The CAS number of Cyclopentanefumaric acid is 5469-39-6.
What is the molecular formula of Cyclopentanefumaric acid?
The molecular formula of Cyclopentanefumaric acid is C9H12O4.
What is the molecular weight of Cyclopentanefumaric acid?
The molecular weight of Cyclopentanefumaric acid is 184.07 g/mol.
Where can I buy Cyclopentanefumaric acid?
You can request a quote for Cyclopentanefumaric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanefumaric acid?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanefumaric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.