![Bicyclo[2.2.1]hept-2-yl isothiocyanate structure](/static/products/1437/14370-23-1.webp)
Bicyclo[2.2.1]hept-2-yl isothiocyanate
TL;DR: Bicyclo[2.2.1]hept-2-yl isothiocyanate (CAS 14370-23-1) is a chemical compound with molecular formula C8H11NS and molecular weight 153.06122 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-isothiocyanatobicyclo[2.2.1]heptane
Also Known As: 2-Isothiocyanatobicyclo[2.2.1]heptane, 2-Isothiocyanato-bicyclo[2.2.1]heptane, 2-isothiocyanatonorbornane, Bicyclo[2.2.1]hept-2-yl isothiocyanate, exo-2-Norbornylisothiocyanate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H11NS |
| Molecular Weight | 153.06122 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 153.06122 Da |
| Heavy Atoms | 10 |
| Complexity | 184.0 |
| SMILES | C1CC2CC1CC2N=C=S |
| InChIKey | RBGDFYZLQKZUCO-UHFFFAOYSA-N |
Chemical Property Profile of Bicyclo[2.2.1]hept-2-yl isothiocyanate
Property Insights of Bicyclo[2.2.1]hept-2-yl isothiocyanate
The XLogP value of 3.3 indicates that Bicyclo[2.2.1]hept-2-yl isothiocyanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.5 Ų, Bicyclo[2.2.1]hept-2-yl isothiocyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.1]hept-2-yl isothiocyanate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bicyclo[2.2.1]hept-2-yl isothiocyanate?
The CAS number of Bicyclo[2.2.1]hept-2-yl isothiocyanate is 14370-23-1.
What is the molecular formula of Bicyclo[2.2.1]hept-2-yl isothiocyanate?
The molecular formula of Bicyclo[2.2.1]hept-2-yl isothiocyanate is C8H11NS.
What is the molecular weight of Bicyclo[2.2.1]hept-2-yl isothiocyanate?
The molecular weight of Bicyclo[2.2.1]hept-2-yl isothiocyanate is 153.06122 g/mol.
Where can I buy Bicyclo[2.2.1]hept-2-yl isothiocyanate?
You can request a quote for Bicyclo[2.2.1]hept-2-yl isothiocyanate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bicyclo[2.2.1]hept-2-yl isothiocyanate?
Yes, CoreyChem provides custom synthesis services for Bicyclo[2.2.1]hept-2-yl isothiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.