双环［2.2.1］庚烷-2-甲腈
TL;DR: 双环［2.2.1］庚烷-2-甲腈 (CAS 2234-26-6) 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.
双环［2.2.1］庚烷-2-甲腈
bicyclo[2.2.1]heptane-2-carbonitrile
Also Known As: 2-Norbornanecarbonitrile, Bicyclo[2.2.1]heptane-2-carbonitrile, 2-cyanonorbornane, Norbornane-2-carbonitrile, 2-norbornyl cyanide
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 121.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 121.08915 |
| Heavy Atoms | 9 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 2234-26-6 |
|---|---|
| SMILES | C1CC2CC1CC2C#N |
| InChIKey | GAHKEUUHTHVKEA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双环［2.2.1］庚烷-2-甲腈 (CAS 2234-26-6), with molecular formula C8H11N and molecular weight 121.09 g/mol. IUPAC: bicyclo[2.2.1]heptane-2-carbonitrile.
Chemical Property Profile of 双环［2.2.1］庚烷-2-甲腈
Property Insights of 双环［2.2.1］庚烷-2-甲腈
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 双环［2.2.1］庚烷-2-甲腈. With a topological polar surface area (TPSA) of 23.8 Ų, 双环［2.2.1］庚烷-2-甲腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双环［2.2.1］庚烷-2-甲腈 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 双环［2.2.1］庚烷-2-甲腈?
The CAS number of 双环［2.2.1］庚烷-2-甲腈 is 2234-26-6.
What is the molecular formula of 双环［2.2.1］庚烷-2-甲腈?
The molecular formula of 双环［2.2.1］庚烷-2-甲腈 is C8H11N.
What is the molecular weight of 双环［2.2.1］庚烷-2-甲腈?
The molecular weight of 双环［2.2.1］庚烷-2-甲腈 is 121.09 g/mol.
Where can I buy 双环［2.2.1］庚烷-2-甲腈?
You can request a quote for 双环［2.2.1］庚烷-2-甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双环［2.2.1］庚烷-2-甲腈?
Yes, KEHONG BIO provides custom synthesis services for 双环［2.2.1］庚烷-2-甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.