(2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid
TL;DR: (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid (CAS 1164523-09-4) is a chemical compound with molecular formula C13H12O4 and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid
Also Known As: (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid, (Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid, (Z)-3-Methyl-4-[1-phenyl-meth-(Z)-ylidene]-pent-2-enedioic acid
| Molecular Formula | C13H12O4 |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.1855 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.07356 |
| Heavy Atoms | 17 |
| Complexity | 483.40076 |
Chemical Identifiers
| CAS Number | 1164523-09-4 |
|---|---|
| SMILES | C/C(=C/C(=O)O)/C(=C/C1=CC=CC=C1)/C(=O)O |
Product Overview
(2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid (CAS 1164523-09-4), with molecular formula C13H12O4 and molecular weight 232.07 g/mol. IUPAC: (Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid.
Chemical Property Profile of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid
Property Insights of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid
The XLogP value of 2.1855 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid. Following Lipinski's Rule of Five, (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic 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 (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid?
The CAS number of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid is 1164523-09-4.
What is the molecular formula of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid?
The molecular formula of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid is C13H12O4.
What is the molecular weight of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid?
The molecular weight of (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid is 232.07 g/mol.
Where can I buy (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid?
You can request a quote for (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid?
Yes, KEHONG BIO provides custom synthesis services for (2Z,4Z)-4-benzylidene-3-methylpent-2-enedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.