![(1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile structure](/static/products/121/1212443-24-7.webp)
(1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile
TL;DR: (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile (CAS 1212443-24-7) is a chemical compound with molecular formula C10H15N and molecular weight 149.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile
Also Known As: (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile, (1R,4R)-2,5-dimethylbicyclo[2.2.1]heptane-3-carbonitrile
Technical Specifications
| Molecular Formula | C10H15N |
| Molecular Weight | 149.12045 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 149.12045 Da |
| Heavy Atoms | 11 |
| Complexity | 212.0 |
| SMILES | CC1C[C@@H]2C[C@H]1C(C2C)C#N |
| InChIKey | MKFSLBADTQAFOB-CTOGJURTSA-N |
Chemical Property Profile of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile
Property Insights of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile. With a topological polar surface area (TPSA) of 23.8 Ų, (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile 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
What is the CAS number of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile?
The CAS number of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile is 1212443-24-7.
What is the molecular formula of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile?
The molecular formula of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile is C10H15N.
What is the molecular weight of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile?
The molecular weight of (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile is 149.12045 g/mol.
Where can I buy (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile?
You can request a quote for (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile?
Yes, CoreyChem provides custom synthesis services for (1R,4R)-3,6-dimethylbicyclo[2.2.1]heptane-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.