![1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione structure](/static/products/1321/132101-22-5.webp)
1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
TL;DR: 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione (CAS 132101-22-5) is a chemical compound with molecular formula C11H13N3O4 and molecular weight 251.0906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: Thymidine,5'-deoxy-5'-isocyano- (9CI), 1-[4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Technical Specifications
| Molecular Formula | C11H13N3O4 |
| Molecular Weight | 251.0906 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 83.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.0906 Da |
| Heavy Atoms | 18 |
| Complexity | 464.0 |
| SMILES | CC1=CN(C(=O)NC1=O)C2CC(C(O2)C[N+]#[C-])O |
| InChIKey | GBWQKYUVGHOFTL-UHFFFAOYSA-N |
Chemical Property Profile of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Property Insights of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
The XLogP value of -1.3 indicates that 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione. Following Lipinski's Rule of Five, 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione?
The CAS number of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione is 132101-22-5.
What is the molecular formula of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione?
The molecular formula of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione is C11H13N3O4.
What is the molecular weight of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione?
The molecular weight of 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione is 251.0906 g/mol.
Where can I buy 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione?
You can request a quote for 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 1-[4-Hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.