rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane
TL;DR: rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane (CAS 20309-77-7) is a chemical compound with molecular formula C9H18 and molecular weight 126.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(3S,4S)-1,1,3,4-tetramethylcyclopentane
Also Known As: trans-1,1,3,4-Tetramethylcyclopentane, 1,1,3,4-Tetramethylcyclopentane #, Cyclopentane, 1,1,3,4-tetramethyl-, trans-, (3S,4S)-1,1,3,4-tetramethylcyclopentane, 1,1,3alpha,4beta-Tetramethylcyclopentane
| Molecular Formula | C9H18 |
|---|---|
| Molecular Weight | 126.14 g/mol |
| LogP | 3.0786 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.140854 |
| Heavy Atoms | 9 |
| Complexity | 90.605934 |
Chemical Identifiers
| CAS Number | 20309-77-7 |
|---|---|
| SMILES | C[C@H]1CC(C[C@@H]1C)(C)C |
Product Overview
rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane (CAS 20309-77-7), with molecular formula C9H18 and molecular weight 126.14 g/mol. IUPAC: trans-(3S,4S)-1,1,3,4-tetramethylcyclopentane.
Chemical Property Profile of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane
Property Insights of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane
The XLogP value of 3.0786 indicates that rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane has 0 hydrogen bond donor(s) and 0 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 rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane?
The CAS number of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane is 20309-77-7.
What is the molecular formula of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane?
The molecular formula of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane is C9H18.
What is the molecular weight of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane?
The molecular weight of rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane is 126.14 g/mol.
Where can I buy rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane?
You can request a quote for rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane?
Yes, KEHONG BIO provides custom synthesis services for rel-(3S,4S)a1,1,3,4aTetramethylcyclopentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.