(2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid
TL;DR: (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid (CAS 374701-73-2) 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.
(2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid
Also Known As: (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid, 5-(1,3-benzodioxol-5-yl)-3-methyl-2,4-pentadienoic acid, (2Z,4E)-5-(benzo[d][1,3]dioxol-5-yl)-3-methylpenta-2,4-dienoic acid
| Molecular Formula | C13H12O4 |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.4594 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.07356 |
| Heavy Atoms | 17 |
| Complexity | 500.14096 |
Chemical Identifiers
| CAS Number | 374701-73-2 |
|---|---|
| SMILES | C/C(=C/C(=O)O)/C=C/C1=CC2=C(C=C1)OCO2 |
Product Overview
(2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid (CAS 374701-73-2), with molecular formula C13H12O4 and molecular weight 232.07 g/mol. IUPAC: (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid.
Chemical Property Profile of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid
Property Insights of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid
The XLogP value of 2.4594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid. With a topological polar surface area (TPSA) of 55.76 Ų, (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid has 1 hydrogen bond donor(s) and 3 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,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid?
The CAS number of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid is 374701-73-2.
What is the molecular formula of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid?
The molecular formula of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid is C13H12O4.
What is the molecular weight of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid?
The molecular weight of (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid is 232.07 g/mol.
Where can I buy (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid?
You can request a quote for (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2Z,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.