Cyclopropane, 1,1-diethynyl-
TL;DR: Cyclopropane, 1,1-diethynyl- (CAS 72323-66-1) is a chemical compound with molecular formula C7H6 and molecular weight 90.04695 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-diethynylcyclopropane
Also Known As: 1,1-diethynylcyclopropane, Cyclopropane, 1,1-diethynyl-
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H6 |
| Molecular Weight | 90.04695 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 90.04695 Da |
| Heavy Atoms | 7 |
| Complexity | 147.0 |
| SMILES | C#CC1(CC1)C#C |
| InChIKey | NYLVKOBKPNQZTK-UHFFFAOYSA-N |
Chemical Property Profile of Cyclopropane, 1,1-diethynyl-
Property Insights of Cyclopropane, 1,1-diethynyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopropane, 1,1-diethynyl-. With a topological polar surface area (TPSA) of 0.0 Ų, Cyclopropane, 1,1-diethynyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopropane, 1,1-diethynyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Cyclopropane, 1,1-diethynyl-?
The CAS number of Cyclopropane, 1,1-diethynyl- is 72323-66-1.
What is the molecular formula of Cyclopropane, 1,1-diethynyl-?
The molecular formula of Cyclopropane, 1,1-diethynyl- is C7H6.
What is the molecular weight of Cyclopropane, 1,1-diethynyl-?
The molecular weight of Cyclopropane, 1,1-diethynyl- is 90.04695 g/mol.
Where can I buy Cyclopropane, 1,1-diethynyl-?
You can request a quote for Cyclopropane, 1,1-diethynyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclopropane, 1,1-diethynyl-?
Yes, CoreyChem provides custom synthesis services for Cyclopropane, 1,1-diethynyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.