![4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid structure](/static/products/5688/5688-06-2.webp)
4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid
TL;DR: 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid (CAS 5688-06-2) is a chemical compound with molecular formula C15H24O9 and molecular weight 348.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4,6-bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid
Also Known As: 5-oxopentanoic acid trimer, BAS 00238818, BIM-0022117.P001, 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid, AB01316412-02
| Molecular Formula | C15H24O9 |
|---|---|
| Molecular Weight | 348.14 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 348.14203 |
| Heavy Atoms | 24 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 5688-06-2 |
|---|---|
| SMILES | C(CC1OC(OC(O1)CCCC(=O)O)CCCC(=O)O)CC(=O)O |
| InChIKey | JSIBAPWGMKZTGC-UHFFFAOYSA-N |
Product Overview
4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid (CAS 5688-06-2), with molecular formula C15H24O9 and molecular weight 348.14 g/mol. IUPAC: 4-[4,6-bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid.
Chemical Property Profile of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid
Property Insights of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid. The TPSA of 140.0 Ų indicates high polarity, suggesting 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid has 3 hydrogen bond donor(s) and 9 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-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid?
The CAS number of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid is 5688-06-2.
What is the molecular formula of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid?
The molecular formula of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid is C15H24O9.
What is the molecular weight of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid?
The molecular weight of 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid is 348.14 g/mol.
Where can I buy 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid?
You can request a quote for 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4,6-Bis(3-carboxypropyl)-1,3,5-trioxan-2-yl]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.