![(3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one structure](/static/products/3977/39778-83-1.webp)
(3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one
TL;DR: (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one (CAS 39778-83-1) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,6aS)-3a-methyl-4,5,6,6a-tetrahydro-3H-cyclopenta[b]furan-2-one
Also Known As: 3a-methyl-cis-hexahydrocyclopentafuran-2-one, (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one, (1S,5S)-1-methyl-4-oxabicyclo[3.3.0]octan-3-one, (1S,5S)-5-Methyl-2-oxabicyclo[3.3.0]octan-3-one, (1beta)-2-Oxa-5beta-methylbicyclo[3.3.0]octane-3-one
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 39778-83-1 |
|---|---|
| SMILES | C[C@@]12CCC[C@@H]1OC(=O)C2 |
| InChIKey | NLLYRTZBTAFFQH-XPUUQOCRSA-N |
Product Overview
(3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one (CAS 39778-83-1), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: (3aS,6aS)-3a-methyl-4,5,6,6a-tetrahydro-3H-cyclopenta[b]furan-2-one.
Chemical Property Profile of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one
Property Insights of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-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 (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one?
The CAS number of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one is 39778-83-1.
What is the molecular formula of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one?
The molecular formula of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one is C8H12O2.
What is the molecular weight of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one?
The molecular weight of (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one is 140.08 g/mol.
Where can I buy (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one?
You can request a quote for (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3aS,6aS)-3a-Methylhexahydro-2H-cyclopenta[b]furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.