Hexahydro-3,6-methanophthalic anhydride
TL;DR: Hexahydro-3,6-methanophthalic anhydride (CAS 6004-79-1) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxatricyclo[5.2.1.02,6]decane-3,5-dione
Also Known As: Hexahydro-4,7-methanoisobenzofuran-1,3-dione, glipizide, Hexahydro-3,6-methanophthalic anhydride, Norbornanedicarboxylic anhydride, 4-oxatricyclo[5.2.1.02,6]decane-3,5-dione
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 6004-79-1 |
|---|---|
| SMILES | C1CC2CC1C3C2C(=O)OC3=O |
| InChIKey | LQOPXMZSGSTGMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexahydro-3,6-methanophthalic anhydride (CAS 6004-79-1), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 4-oxatricyclo[5.2.1.02,6]decane-3,5-dione.
Chemical Property Profile of Hexahydro-3,6-methanophthalic anhydride
Property Insights of Hexahydro-3,6-methanophthalic anhydride
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydro-3,6-methanophthalic anhydride. With a topological polar surface area (TPSA) of 43.4 Ų, Hexahydro-3,6-methanophthalic anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexahydro-3,6-methanophthalic anhydride has 0 hydrogen bond donor(s) and 3 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 Hexahydro-3,6-methanophthalic anhydride?
The CAS number of Hexahydro-3,6-methanophthalic anhydride is 6004-79-1.
What is the molecular formula of Hexahydro-3,6-methanophthalic anhydride?
The molecular formula of Hexahydro-3,6-methanophthalic anhydride is C9H10O3.
What is the molecular weight of Hexahydro-3,6-methanophthalic anhydride?
The molecular weight of Hexahydro-3,6-methanophthalic anhydride is 166.06 g/mol.
Where can I buy Hexahydro-3,6-methanophthalic anhydride?
You can request a quote for Hexahydro-3,6-methanophthalic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydro-3,6-methanophthalic anhydride?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-3,6-methanophthalic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.