2,3,4-Trimethyl-1,4-pentadiene
TL;DR: 2,3,4-Trimethyl-1,4-pentadiene (CAS 72014-90-5) is a chemical compound with molecular formula C8H14 and molecular weight 110.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trimethylpenta-1,4-diene
Also Known As: 2,3,4-Trimethyl-1,4-pentadiene, 2,3,4-trimethylpenta-1,4-diene, 1,4-Pentadiene, 2,3,4-trimethyl-, 2,3,4-Trimethyl-1,4-pentadien, 2,3,4-Trimethyl-1,4-pentadiene #
| Molecular Formula | C8H14 |
|---|---|
| Molecular Weight | 110.11 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.10955 |
| Heavy Atoms | 8 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 72014-90-5 |
|---|---|
| SMILES | CC(C(=C)C)C(=C)C |
| InChIKey | AFQPKTBBNYINMQ-UHFFFAOYSA-N |
Product Overview
2,3,4-Trimethyl-1,4-pentadiene (CAS 72014-90-5), with molecular formula C8H14 and molecular weight 110.11 g/mol. IUPAC: 2,3,4-trimethylpenta-1,4-diene.
Chemical Property Profile of 2,3,4-Trimethyl-1,4-pentadiene
Property Insights of 2,3,4-Trimethyl-1,4-pentadiene
The XLogP value of 3.7 indicates that 2,3,4-Trimethyl-1,4-pentadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3,4-Trimethyl-1,4-pentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4-Trimethyl-1,4-pentadiene 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 2,3,4-Trimethyl-1,4-pentadiene?
The CAS number of 2,3,4-Trimethyl-1,4-pentadiene is 72014-90-5.
What is the molecular formula of 2,3,4-Trimethyl-1,4-pentadiene?
The molecular formula of 2,3,4-Trimethyl-1,4-pentadiene is C8H14.
What is the molecular weight of 2,3,4-Trimethyl-1,4-pentadiene?
The molecular weight of 2,3,4-Trimethyl-1,4-pentadiene is 110.11 g/mol.
Where can I buy 2,3,4-Trimethyl-1,4-pentadiene?
You can request a quote for 2,3,4-Trimethyl-1,4-pentadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trimethyl-1,4-pentadiene?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trimethyl-1,4-pentadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.