Acetyl hexamethyl tetralin, (S)-
TL;DR: Acetyl hexamethyl tetralin, (S)- (CAS 85549-79-7) is a chemical compound with molecular formula C18H26O and molecular weight 258.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6S)-3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl]ethanone
Also Known As: Tonalid, (S)-Fixolide, Acetyl hexamethyl tetralin, (S)-, J1.216.574I, (S)-7-acetyl-1,1,3,4,4,6-hexamethyl-1,2,3,4-tetrahydronaphthalene
| Molecular Formula | C18H26O |
|---|---|
| Molecular Weight | 258.20 g/mol |
| LogP | 4.79262 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.19836 |
| Heavy Atoms | 19 |
| Complexity | 534.8664 |
Chemical Identifiers
| CAS Number | 85549-79-7 |
|---|---|
| SMILES | C[C@H]1CC(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)(C)C |
Product Overview
Acetyl hexamethyl tetralin, (S)- (CAS 85549-79-7), with molecular formula C18H26O and molecular weight 258.20 g/mol. IUPAC: 1-[(6S)-3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl]ethanone.
Chemical Property Profile of Acetyl hexamethyl tetralin, (S)-
Property Insights of Acetyl hexamethyl tetralin, (S)-
The XLogP value of 4.79262 indicates that Acetyl hexamethyl tetralin, (S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Acetyl hexamethyl tetralin, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetyl hexamethyl tetralin, (S)- has 0 hydrogen bond donor(s) and 1 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 Acetyl hexamethyl tetralin, (S)-?
The CAS number of Acetyl hexamethyl tetralin, (S)- is 85549-79-7.
What is the molecular formula of Acetyl hexamethyl tetralin, (S)-?
The molecular formula of Acetyl hexamethyl tetralin, (S)- is C18H26O.
What is the molecular weight of Acetyl hexamethyl tetralin, (S)-?
The molecular weight of Acetyl hexamethyl tetralin, (S)- is 258.20 g/mol.
Where can I buy Acetyl hexamethyl tetralin, (S)-?
You can request a quote for Acetyl hexamethyl tetralin, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetyl hexamethyl tetralin, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Acetyl hexamethyl tetralin, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.