1,2,4-Cyclopentatriene
TL;DR: 1,2,4-Cyclopentatriene (CAS 98206-69-0) is a chemical compound with molecular formula C5H4 and molecular weight 64.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopenta-1,2,4-triene
Also Known As: 1,2,4-Cyclopentatriene, Cyclopenta-1,2,4-triene, 1,3,5-cyclopentatriene, cyclopenta-2,4-dien-1-ylidene, 2,4-Cyclopentadienylideneradical
| Molecular Formula | C5H4 |
|---|---|
| Molecular Weight | 64.03 g/mol |
| LogP | 1.2675 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 64.0313 |
| Heavy Atoms | 5 |
| Complexity | 91.20672 |
Chemical Identifiers
| CAS Number | 98206-69-0 |
|---|---|
| SMILES | C1=CC=C=C1 |
Product Overview
1,2,4-Cyclopentatriene (CAS 98206-69-0), with molecular formula C5H4 and molecular weight 64.03 g/mol. IUPAC: cyclopenta-1,2,4-triene.
Chemical Property Profile of 1,2,4-Cyclopentatriene
Property Insights of 1,2,4-Cyclopentatriene
The XLogP value of 1.2675 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Cyclopentatriene. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,4-Cyclopentatriene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Cyclopentatriene has 0 hydrogen bond donor(s) and 0 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 1,2,4-Cyclopentatriene?
The CAS number of 1,2,4-Cyclopentatriene is 98206-69-0.
What is the molecular formula of 1,2,4-Cyclopentatriene?
The molecular formula of 1,2,4-Cyclopentatriene is C5H4.
What is the molecular weight of 1,2,4-Cyclopentatriene?
The molecular weight of 1,2,4-Cyclopentatriene is 64.03 g/mol.
Where can I buy 1,2,4-Cyclopentatriene?
You can request a quote for 1,2,4-Cyclopentatriene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Cyclopentatriene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Cyclopentatriene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.