Patulin hemiglutarate
TL;DR: Patulin hemiglutarate (CAS 151681-59-3) is a chemical compound with molecular formula C12H12O7 and molecular weight 268.0583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxo-5-[(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl)oxy]pentanoic acid
Also Known As: Patulin hemiglutarate, 5-oxo-5-[(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl)oxy]pentanoic acid, 5-Oxo-5-[(2-oxo-2,6-dihydro-4H-furo[3,2-c]pyran-4-yl)oxy]pentanoic acid, Pentanedioic acid, mono(2,6-dihydro-4-oxo-4H-furo(3,2-c)pyran-4-yl) ester
Technical Specifications
| Molecular Formula | C12H12O7 |
| Molecular Weight | 268.0583 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 268.0583 Da |
| Heavy Atoms | 19 |
| Complexity | 474.0 |
| SMILES | C1C=C2C(=CC(=O)O2)C(O1)OC(=O)CCCC(=O)O |
| InChIKey | QMHRPOVENHUKGH-UHFFFAOYSA-N |
Chemical Property Profile of Patulin hemiglutarate
Property Insights of Patulin hemiglutarate
The XLogP value of -0.6 indicates that Patulin hemiglutarate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Patulin hemiglutarate. Following Lipinski's Rule of Five, Patulin hemiglutarate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Patulin hemiglutarate?
The CAS number of Patulin hemiglutarate is 151681-59-3.
What is the molecular formula of Patulin hemiglutarate?
The molecular formula of Patulin hemiglutarate is C12H12O7.
What is the molecular weight of Patulin hemiglutarate?
The molecular weight of Patulin hemiglutarate is 268.0583 g/mol.
Where can I buy Patulin hemiglutarate?
You can request a quote for Patulin hemiglutarate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Patulin hemiglutarate?
Yes, CoreyChem provides custom synthesis services for Patulin hemiglutarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.