4-Maleimidophenyl isocyanate
TL;DR: 4-Maleimidophenyl isocyanate (CAS 123457-83-0) is a chemical compound with molecular formula C11H6N2O3 and molecular weight 214.03784 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-isocyanatophenyl)pyrrole-2,5-dione
Also Known As: 4-(Maleinimido)phenyl isocyanate, 4-Maleimidophenyl isocyanate, PMPI, p-Maleimidophenylisocyanate, N-(4-Isocyanatophenyl)maleimide
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H6N2O3 |
| Molecular Weight | 214.03784 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.03784 Da |
| Heavy Atoms | 16 |
| Complexity | 370.0 |
| SMILES | C1=CC(=CC=C1N=C=O)N2C(=O)C=CC2=O |
| InChIKey | OJQSISYVGFJJBY-UHFFFAOYSA-N |
Chemical Property Profile of 4-Maleimidophenyl isocyanate
Property Insights of 4-Maleimidophenyl isocyanate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Maleimidophenyl isocyanate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Maleimidophenyl isocyanate. Following Lipinski's Rule of Five, 4-Maleimidophenyl isocyanate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Maleimidophenyl isocyanate?
The CAS number of 4-Maleimidophenyl isocyanate is 123457-83-0.
What is the molecular formula of 4-Maleimidophenyl isocyanate?
The molecular formula of 4-Maleimidophenyl isocyanate is C11H6N2O3.
What is the molecular weight of 4-Maleimidophenyl isocyanate?
The molecular weight of 4-Maleimidophenyl isocyanate is 214.03784 g/mol.
Where can I buy 4-Maleimidophenyl isocyanate?
You can request a quote for 4-Maleimidophenyl isocyanate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Maleimidophenyl isocyanate?
Yes, CoreyChem provides custom synthesis services for 4-Maleimidophenyl isocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.