Peracitol
TL;DR: Peracitol (CAS 527-06-0) is a chemical compound with molecular formula C7H16O7 and molecular weight 212.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptane-1,2,3,4,5,6,7-heptol
Also Known As: Perseitol, Peracitol, Heptitol, Volemitol, D-Volemitol
| Molecular Formula | C7H16O7 |
|---|---|
| Molecular Weight | 212.09 g/mol |
| LogP | -3.7 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.0896 |
| Heavy Atoms | 14 |
| Complexity | 137.0 |
| Melting Point | 187 - 188 °C |
| Boiling Point | 248.00 to 281.00 °C. @ 1013.00 mm Hg |
| Solubility | 64.6 mg/mL at 18 °C |
Chemical Identifiers
| CAS Number | 527-06-0 |
|---|---|
| SMILES | C(C(C(C(C(C(CO)O)O)O)O)O)O |
| InChIKey | OXQKEKGBFMQTML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Peracitol (CAS 527-06-0), with molecular formula C7H16O7 and molecular weight 212.09 g/mol. IUPAC: heptane-1,2,3,4,5,6,7-heptol.
Chemical Property Profile of Peracitol
Property Insights of Peracitol
The XLogP value of -3.7 indicates that Peracitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.0 Ų indicates high polarity, suggesting Peracitol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Peracitol has 7 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Peracitol?
The CAS number of Peracitol is 527-06-0.
What is the molecular formula of Peracitol?
The molecular formula of Peracitol is C7H16O7.
What is the molecular weight of Peracitol?
The molecular weight of Peracitol is 212.09 g/mol.
Where can I buy Peracitol?
You can request a quote for Peracitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Peracitol?
Yes, KEHONG BIO provides custom synthesis services for Peracitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.