1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol
TL;DR: 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol (CAS 64911-68-8) 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,2R,4S,5S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,5-diol
Also Known As: (1S,4S)-Bornane-2alpha,5beta-diol, 1,7,7-Trimethylbicyclo[2.2.1]heptane-2,5-diol, J2.191.915B, 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol, (1S,2R,4S,5S)-1,7,7-Trimethylbicyclo(2.2.1) heptane-2,5-diol
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 64911-68-8 |
|---|---|
| SMILES | C[C@]12C[C@@H]([C@H](C1(C)C)C[C@H]2O)O |
| InChIKey | HLVIHBJQDKVEAL-IBCQBUCCSA-N |
Product Overview
1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol (CAS 64911-68-8), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: (1S,2R,4S,5S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,5-diol.
Chemical Property Profile of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol
Property Insights of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-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 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol?
The CAS number of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol is 64911-68-8.
What is the molecular formula of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol?
The molecular formula of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol is C10H18O2.
What is the molecular weight of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol?
The molecular weight of 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol is 170.13 g/mol.
Where can I buy 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol?
You can request a quote for 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol?
Yes, KEHONG BIO provides custom synthesis services for 1,7,7-Trimethylbicyclo(2.2.1)heptane-2,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.