1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one
TL;DR: 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one (CAS 665-27-0) is a chemical compound with molecular formula C7H10O5 and molecular weight 174.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4-trihydroxy-6-oxabicyclo[3.2.1]octan-7-one
Also Known As: 1,3,4-trihydroxy-6-oxabicyclo[3.2.1]octan-7-one, KST-1B6886, 2,3,5-trihydroxy-7-oxabicyclo[3.2.1]octan-6-one, 1,3,4-Trihydroxy-6-oxa-bicyclo[3.2.1]octan-7-one, 6-Oxabicyclo[3.2.1]octan-7-one,1,3,4-trihydroxy-
| Molecular Formula | C7H10O5 |
|---|---|
| Molecular Weight | 174.05 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.05283 |
| Heavy Atoms | 12 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 665-27-0 |
|---|---|
| SMILES | C1C(C(C2CC1(C(=O)O2)O)O)O |
| InChIKey | QPJRIFFWEBJVFN-UHFFFAOYSA-N |
Product Overview
1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one (CAS 665-27-0), with molecular formula C7H10O5 and molecular weight 174.05 g/mol. IUPAC: 1,3,4-trihydroxy-6-oxabicyclo[3.2.1]octan-7-one.
Chemical Property Profile of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one
Property Insights of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one
The XLogP value of -1.6 indicates that 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one. Following Lipinski's Rule of Five, 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one has 3 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 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one?
The CAS number of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one is 665-27-0.
What is the molecular formula of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one?
The molecular formula of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one is C7H10O5.
What is the molecular weight of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one?
The molecular weight of 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one is 174.05 g/mol.
Where can I buy 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one?
You can request a quote for 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Trihydroxy-6-oxabicyclo[3.2.1]octan-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.