4-(1,3-Dioxolan-2-yl)butanoic acid
TL;DR: 4-(1,3-Dioxolan-2-yl)butanoic acid (CAS 152499-70-2) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(1,3-dioxolan-2-yl)butanoic acid
Also Known As: 4-(1,3-dioxolan-2-yl)butanoic acid, 5,5-ethylenedioxypentanoic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H12O4 |
| Molecular Weight | 160.07356 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.07356 Da |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
| SMILES | C1COC(O1)CCCC(=O)O |
| InChIKey | HWDQPRIRTNVIAL-UHFFFAOYSA-N |
Chemical Property Profile of 4-(1,3-Dioxolan-2-yl)butanoic acid
Property Insights of 4-(1,3-Dioxolan-2-yl)butanoic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,3-Dioxolan-2-yl)butanoic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 4-(1,3-Dioxolan-2-yl)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,3-Dioxolan-2-yl)butanoic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(1,3-Dioxolan-2-yl)butanoic acid?
The CAS number of 4-(1,3-Dioxolan-2-yl)butanoic acid is 152499-70-2.
What is the molecular formula of 4-(1,3-Dioxolan-2-yl)butanoic acid?
The molecular formula of 4-(1,3-Dioxolan-2-yl)butanoic acid is C7H12O4.
What is the molecular weight of 4-(1,3-Dioxolan-2-yl)butanoic acid?
The molecular weight of 4-(1,3-Dioxolan-2-yl)butanoic acid is 160.07356 g/mol.
Where can I buy 4-(1,3-Dioxolan-2-yl)butanoic acid?
You can request a quote for 4-(1,3-Dioxolan-2-yl)butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(1,3-Dioxolan-2-yl)butanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(1,3-Dioxolan-2-yl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.