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hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one
TL;DR: hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one (CAS 6931-48-2) 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.
4-oxatricyclo[4.3.0.03,7]nonan-5-one
Also Known As: hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one
| Molecular Formula | C8H10O2 |
|---|---|
| Molecular Weight | 138.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.06808 |
| Heavy Atoms | 10 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 6931-48-2 |
|---|---|
| SMILES | C1CC2C3CC1C2C(=O)O3 |
| InChIKey | MSJOVMFAHQXWPI-UHFFFAOYSA-N |
Product Overview
hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one (CAS 6931-48-2), with molecular formula C8H10O2 and molecular weight 138.07 g/mol. IUPAC: 4-oxatricyclo[4.3.0.03,7]nonan-5-one.
Chemical Property Profile of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one
Property Insights of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one. With a topological polar surface area (TPSA) of 26.3 Ų, hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one 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 hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one?
The CAS number of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one is 6931-48-2.
What is the molecular formula of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one?
The molecular formula of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one is C8H10O2.
What is the molecular weight of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one?
The molecular weight of hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one is 138.07 g/mol.
Where can I buy hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one?
You can request a quote for hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one?
Yes, KEHONG BIO provides custom synthesis services for hexahydro-3H-1,4-methanocyclopenta[c]furan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.