![(1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol structure](/static/products/2180/21803-49-6.webp)
(1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
TL;DR: (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol (CAS 21803-49-6) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
Also Known As: DHS Activator, (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol, Bicyclo[3.1.1]heptane-2,3-diol, 2,6,6-trimethyl-, (1S,2S,3S,5S)-
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 1.1643 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 207.88412 |
Chemical Identifiers
| CAS Number | 21803-49-6 |
|---|---|
| SMILES | C[C@@]1([C@H]2C[C@H](C2(C)C)C[C@@H]1O)O |
Product Overview
(1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol (CAS 21803-49-6), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol.
Chemical Property Profile of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
Property Insights of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
The XLogP value of 1.1643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol. With a topological polar surface area (TPSA) of 40.46 Ų, (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol has 2 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 (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol?
The CAS number of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol is 21803-49-6.
What is the molecular formula of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol?
The molecular formula of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol is C10H18O2.
What is the molecular weight of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol?
The molecular weight of (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol is 170.13 g/mol.
Where can I buy (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol?
You can request a quote for (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol?
Yes, KEHONG BIO provides custom synthesis services for (1S,2S,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.