Spiropentane-1,1,2,2-d4
TL;DR: Spiropentane-1,1,2,2-d4 (CAS 14996-50-0) is a chemical compound with molecular formula C5H8 and molecular weight 72.08771 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,2,2-tetradeuteriospiro[2.2]pentane
Also Known As: Spiropentane-1,1,2,2-d4, SPIROPENTANE, 1,1,2,2-Tetradeuteriospiro[2.2]pentane, 4,4,5,5-tetradeuteriospiro[2.2]pentane, (1,1,2,2-~2~H_4_)Spiro[2.2]pentane
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H8 |
| Molecular Weight | 72.08771 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 72.08771 Da |
| Heavy Atoms | 5 |
| Complexity | 42.0 |
| SMILES | [2H]C1(C(C12CC2)([2H])[2H])[2H] |
| InChIKey | OGNAOIGAPPSUMG-LNLMKGTHSA-N |
Chemical Property Profile of Spiropentane-1,1,2,2-d4
Property Insights of Spiropentane-1,1,2,2-d4
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiropentane-1,1,2,2-d4. With a topological polar surface area (TPSA) of 0.0 Ų, Spiropentane-1,1,2,2-d4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiropentane-1,1,2,2-d4 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 Spiropentane-1,1,2,2-d4?
The CAS number of Spiropentane-1,1,2,2-d4 is 14996-50-0.
What is the molecular formula of Spiropentane-1,1,2,2-d4?
The molecular formula of Spiropentane-1,1,2,2-d4 is C5H8.
What is the molecular weight of Spiropentane-1,1,2,2-d4?
The molecular weight of Spiropentane-1,1,2,2-d4 is 72.08771 g/mol.
Where can I buy Spiropentane-1,1,2,2-d4?
You can request a quote for Spiropentane-1,1,2,2-d4 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Spiropentane-1,1,2,2-d4?
Yes, CoreyChem provides custom synthesis services for Spiropentane-1,1,2,2-d4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.