![exo-2-Cyanobicyclo[2.2.1]heptane structure](/static/products/321/3211-90-3.png)
exo-2-Cyanobicyclo[2.2.1]heptane
TL;DR: exo-2-Cyanobicyclo[2.2.1]heptane (CAS 3211-90-3) is a chemical compound with molecular formula C8H11N and molecular weight 121.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,4S)-bicyclo[2.2.1]heptane-2-carbonitrile
Also Known As: exo-2-Cyanobicyclo[2.2.1]heptane
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 121.09 g/mol |
| LogP | 1.94618 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 121.08915 |
| Heavy Atoms | 9 |
| Complexity | 156.4408 |
Chemical Identifiers
| CAS Number | 3211-90-3 |
|---|---|
| SMILES | C1C[C@H]2C[C@H]1C[C@H]2C#N |
Product Overview
exo-2-Cyanobicyclo[2.2.1]heptane (CAS 3211-90-3), with molecular formula C8H11N and molecular weight 121.09 g/mol. IUPAC: (1S,2R,4S)-bicyclo[2.2.1]heptane-2-carbonitrile.
Chemical Property Profile of exo-2-Cyanobicyclo[2.2.1]heptane
Property Insights of exo-2-Cyanobicyclo[2.2.1]heptane
The XLogP value of 1.94618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for exo-2-Cyanobicyclo[2.2.1]heptane. With a topological polar surface area (TPSA) of 23.79 Ų, exo-2-Cyanobicyclo[2.2.1]heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, exo-2-Cyanobicyclo[2.2.1]heptane 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 exo-2-Cyanobicyclo[2.2.1]heptane?
The CAS number of exo-2-Cyanobicyclo[2.2.1]heptane is 3211-90-3.
What is the molecular formula of exo-2-Cyanobicyclo[2.2.1]heptane?
The molecular formula of exo-2-Cyanobicyclo[2.2.1]heptane is C8H11N.
What is the molecular weight of exo-2-Cyanobicyclo[2.2.1]heptane?
The molecular weight of exo-2-Cyanobicyclo[2.2.1]heptane is 121.09 g/mol.
Where can I buy exo-2-Cyanobicyclo[2.2.1]heptane?
You can request a quote for exo-2-Cyanobicyclo[2.2.1]heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for exo-2-Cyanobicyclo[2.2.1]heptane?
Yes, KEHONG BIO provides custom synthesis services for exo-2-Cyanobicyclo[2.2.1]heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.