cis-Tetrahydropentalene-2,5(1H,3H)-dione
TL;DR: cis-Tetrahydropentalene-2,5(1H,3H)-dione (CAS 51716-63-3) is a chemical compound with molecular formula C8H10O2 and molecular weight 138.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3a,4,6,6a-hexahydropentalene-2,5-dione
Also Known As: cis-Bicyclo[3.3.0]octane-3,7-dione, tetrahydropentalene-2,5(1h,3h)-dione, cis-Tetrahydropentalene-2,5(1H,3H)-dione, TETRAHYDROPENTALENE-2,5-DIONE, Weiss diketone
| Molecular Formula | C8H10O2 |
|---|---|
| Molecular Weight | 138.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.06808 |
| Heavy Atoms | 10 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 51716-63-3 |
|---|---|
| SMILES | C1C2CC(=O)CC2CC1=O |
| InChIKey | HAFQHNGZPQYKFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-Tetrahydropentalene-2,5(1H,3H)-dione (CAS 51716-63-3), with molecular formula C8H10O2 and molecular weight 138.07 g/mol. IUPAC: 1,3,3a,4,6,6a-hexahydropentalene-2,5-dione.
Chemical Property Profile of cis-Tetrahydropentalene-2,5(1H,3H)-dione
Property Insights of cis-Tetrahydropentalene-2,5(1H,3H)-dione
The XLogP value of -0.4 indicates that cis-Tetrahydropentalene-2,5(1H,3H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.1 Ų, cis-Tetrahydropentalene-2,5(1H,3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-Tetrahydropentalene-2,5(1H,3H)-dione has 0 hydrogen bond donor(s) and 2 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 cis-Tetrahydropentalene-2,5(1H,3H)-dione?
The CAS number of cis-Tetrahydropentalene-2,5(1H,3H)-dione is 51716-63-3.
What is the molecular formula of cis-Tetrahydropentalene-2,5(1H,3H)-dione?
The molecular formula of cis-Tetrahydropentalene-2,5(1H,3H)-dione is C8H10O2.
What is the molecular weight of cis-Tetrahydropentalene-2,5(1H,3H)-dione?
The molecular weight of cis-Tetrahydropentalene-2,5(1H,3H)-dione is 138.07 g/mol.
Where can I buy cis-Tetrahydropentalene-2,5(1H,3H)-dione?
You can request a quote for cis-Tetrahydropentalene-2,5(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-Tetrahydropentalene-2,5(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for cis-Tetrahydropentalene-2,5(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.