3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile
TL;DR: 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile (CAS 142559-85-1) is a chemical compound with molecular formula C12H12N4 and molecular weight 212.1062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile
Also Known As: 3-Azido-5-cyano-1,1-dimethylindane, 3-azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile
Technical Specifications
| Molecular Formula | C12H12N4 |
| Molecular Weight | 212.1062 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.1062 Da |
| Heavy Atoms | 16 |
| Complexity | 372.0 |
| SMILES | CC1(CC(C2=C1C=CC(=C2)C#N)N=[N+]=[N-])C |
| InChIKey | UEZPGALNOWTKRT-UHFFFAOYSA-N |
Chemical Property Profile of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile
Property Insights of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile
The XLogP value of 3.8 indicates that 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.2 Ų, 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile has 0 hydrogen bond donor(s) and 3 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-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile?
The CAS number of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile is 142559-85-1.
What is the molecular formula of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile?
The molecular formula of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile is C12H12N4.
What is the molecular weight of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile?
The molecular weight of 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile is 212.1062 g/mol.
Where can I buy 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile?
You can request a quote for 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 3-Azido-1,1-dimethyl-2,3-dihydroindene-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.