![4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid structure](/static/products/7617/76174-14-6.webp)
4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid
TL;DR: 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid (CAS 76174-14-6) is a chemical compound with molecular formula C11H18O5 and molecular weight 230.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(3-hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid
Also Known As: 2-Butenoic acid, 4-(2-(3-hydroxybutyl)-1,3-dioxolan-2-yl)-, 2-Butenoic acid,4-[2-(3-hydroxybutyl)-1,3-dioxolan-2-yl]-
| Molecular Formula | C11H18O5 |
|---|---|
| Molecular Weight | 230.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 230.11542 |
| Heavy Atoms | 16 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 76174-14-6 |
|---|---|
| SMILES | CC(CCC1(OCCO1)CC=CC(=O)O)O |
| InChIKey | QTWRYDLTIZCYDQ-UHFFFAOYSA-N |
Product Overview
4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid (CAS 76174-14-6), with molecular formula C11H18O5 and molecular weight 230.12 g/mol. IUPAC: 4-[2-(3-hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid.
Chemical Property Profile of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid
Property Insights of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid. Following Lipinski's Rule of Five, 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid has 2 hydrogen bond donor(s) and 5 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 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid?
The CAS number of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid is 76174-14-6.
What is the molecular formula of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid?
The molecular formula of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid is C11H18O5.
What is the molecular weight of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid?
The molecular weight of 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid is 230.12 g/mol.
Where can I buy 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid?
You can request a quote for 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(3-Hydroxybutyl)-1,3-dioxolan-2-yl]but-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.