![4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one structure](/static/products/558/5587-71-3.png)
4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one
TL;DR: 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one (CAS 5587-71-3) 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.
4,5,6,7-tetrahydro-3H-cyclopenta[b]pyran-2-one
Also Known As: 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one, 4,5,6,7-Tetrahydro-3H-cyclopenta[b]pyran-2-one, 4,5,6,7-tetrahydro-3H-cyclopenta[e]pyran-2-one, 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one #
| Molecular Formula | C8H10O2 |
|---|---|
| Molecular Weight | 138.07 g/mol |
| LogP | 0.7 |
| 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 | 203.0 |
Chemical Identifiers
| CAS Number | 5587-71-3 |
|---|---|
| SMILES | C1CC2=C(C1)OC(=O)CC2 |
| InChIKey | HIYYRAXHGNXDNA-UHFFFAOYSA-N |
Product Overview
4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one (CAS 5587-71-3), with molecular formula C8H10O2 and molecular weight 138.07 g/mol. IUPAC: 4,5,6,7-tetrahydro-3H-cyclopenta[b]pyran-2-one.
Chemical Property Profile of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one
Property Insights of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one. With a topological polar surface area (TPSA) of 26.3 Ų, 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-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 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one?
The CAS number of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one is 5587-71-3.
What is the molecular formula of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one?
The molecular formula of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one is C8H10O2.
What is the molecular weight of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one?
The molecular weight of 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one is 138.07 g/mol.
Where can I buy 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one?
You can request a quote for 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-Tetrahydrocyclopenta[b]pyran-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.