cis-Octahydro-4a(2H)-naphthyl acetate
TL;DR: cis-Octahydro-4a(2H)-naphthyl acetate (CAS 36144-10-2) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-4a-yl acetate
Also Known As: cis-9-Decalinyl acetate, trans-9-Decalinyl acetate, cis-Octahydro-4a(2H)-naphthyl acetate, cis-octahydro-4a -naphthylacetate, octahydronaphthalen-4a(2h)-ylacetate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 36144-10-2 |
|---|---|
| SMILES | CC(=O)OC12CCCCC1CCCC2 |
| InChIKey | COHJFBQTCBAHIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-Octahydro-4a(2H)-naphthyl acetate (CAS 36144-10-2), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-4a-yl acetate.
Chemical Property Profile of cis-Octahydro-4a(2H)-naphthyl acetate
Property Insights of cis-Octahydro-4a(2H)-naphthyl acetate
The XLogP value of 3.0 indicates that cis-Octahydro-4a(2H)-naphthyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, cis-Octahydro-4a(2H)-naphthyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-Octahydro-4a(2H)-naphthyl acetate 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 cis-Octahydro-4a(2H)-naphthyl acetate?
The CAS number of cis-Octahydro-4a(2H)-naphthyl acetate is 36144-10-2.
What is the molecular formula of cis-Octahydro-4a(2H)-naphthyl acetate?
The molecular formula of cis-Octahydro-4a(2H)-naphthyl acetate is C12H20O2.
What is the molecular weight of cis-Octahydro-4a(2H)-naphthyl acetate?
The molecular weight of cis-Octahydro-4a(2H)-naphthyl acetate is 196.15 g/mol.
Where can I buy cis-Octahydro-4a(2H)-naphthyl acetate?
You can request a quote for cis-Octahydro-4a(2H)-naphthyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-Octahydro-4a(2H)-naphthyl acetate?
Yes, KEHONG BIO provides custom synthesis services for cis-Octahydro-4a(2H)-naphthyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.