3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)
TL;DR: 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) (CAS 20430-13-1) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E)-3-methyl-5-phenylpenta-2,4-dienoic acid
Also Known As: ChemDiv3_000287, 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans), (2e,4e)-3-methyl-5-phenyl-2,4-pentadienoic acid, 3-Methyl-5-phenyl-2-trans-4-trans-pentadienoic acid, 2,4-Pentadienoic acid, 3-methyl-5-phenyl-, (E,E)-
| Molecular Formula | C12H12O2 |
|---|---|
| Molecular Weight | 188.08 g/mol |
| LogP | 2.7307 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.08372 |
| Heavy Atoms | 14 |
| Complexity | 361.16794 |
Chemical Identifiers
| CAS Number | 20430-13-1 |
|---|---|
| SMILES | C/C(=C\C(=O)O)/C=C/C1=CC=CC=C1 |
Product Overview
3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) (CAS 20430-13-1), with molecular formula C12H12O2 and molecular weight 188.08 g/mol. IUPAC: (2E,4E)-3-methyl-5-phenylpenta-2,4-dienoic acid.
Chemical Property Profile of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)
Property Insights of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)
The XLogP value of 2.7307 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans). With a topological polar surface area (TPSA) of 37.3 Ų, 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) has 1 hydrogen bond donor(s) and 1 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 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)?
The CAS number of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) is 20430-13-1.
What is the molecular formula of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)?
The molecular formula of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) is C12H12O2.
What is the molecular weight of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)?
The molecular weight of 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) is 188.08 g/mol.
Where can I buy 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)?
You can request a quote for 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans)?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5-phenyl-pentadienoic acid (2,4-trans) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.