6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate
TL;DR: 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate (CAS 353241-64-2) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-oxo-1-tricyclo[4.3.1.03,8]decanyl) acetate
Also Known As: 2-(Acetyloxy)octahydro-2,6-methano-5H-inden-5-one, 5-oxotricyclo[4.3.1.0~3,8~]dec-1-yl acetate, 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate, AH-034/36863040
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 1.6973 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 335.75894 |
Chemical Identifiers
| CAS Number | 353241-64-2 |
|---|---|
| SMILES | CC(=O)OC12CC3CC(C1)C(=O)CC3C2 |
Product Overview
6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate (CAS 353241-64-2), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: (5-oxo-1-tricyclo[4.3.1.03,8]decanyl) acetate.
Chemical Property Profile of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate
Property Insights of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate
The XLogP value of 1.6973 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate. With a topological polar surface area (TPSA) of 43.37 Ų, 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate 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 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate?
The CAS number of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate is 353241-64-2.
What is the molecular formula of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate?
The molecular formula of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate is C12H16O3.
What is the molecular weight of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate?
The molecular weight of 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate is 208.11 g/mol.
Where can I buy 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate?
You can request a quote for 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 6-oxooctahydro-2H-2,5-methanoinden-2-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.