3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-
TL;DR: 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- (CAS 15373-31-6) 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.
2-(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile
Also Known As: Cantryl, 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-, 2-(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile, 2,2,3-Trimethylcyclopent-3-enylacetonitrile, 2,2,3-trimethyl-3-cyclopentene-1-acetonitrile
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H15N |
| Molecular Weight | 149.12045 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.12045 Da |
| Heavy Atoms | 11 |
| Complexity | 227.0 |
| SMILES | CC1=CCC(C1(C)C)CC#N |
| InChIKey | YYJOTFQPYNOYAB-UHFFFAOYSA-N |
Chemical Property Profile of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-
Property Insights of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-. With a topological polar surface area (TPSA) of 23.8 Ų, 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- 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 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-?
The CAS number of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- is 15373-31-6.
What is the molecular formula of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-?
The molecular formula of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- is C10H15N.
What is the molecular weight of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-?
The molecular weight of 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- is 149.12045 g/mol.
Where can I buy 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-?
You can request a quote for 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl-?
Yes, CoreyChem provides custom synthesis services for 3-Cyclopentene-1-acetonitrile, 2,2,3-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.