M-Cumenyl Methylcarbamate
TL;DR: M-Cumenyl Methylcarbamate (CAS 64-00-6) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-propan-2-ylphenyl) N-methylcarbamate
Also Known As: m-Cumenyl methylcarbamate, Hercules 5727, Compound 10854, m-Cumenol methylcarbamate, 3-Isopropylphenyl methylcarbamate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 192.0 |
| Melting Point | 162 to 165 °F (EPA, 1998) |
| Boiling Point | 143 °C @760 [mm Hg] |
| Vapor Pressure | 0.00439 [mmHg] |
| Solubility | 10% in isophorone; 10% in xylene; 20% in toluene; 20% in toluene; 40% in isopropanol; 50% in acetone; 60% in dimethylformamide. Practically insoluble in cyclohexane. |
| SMILES | CC(C)C1=CC(=CC=C1)OC(=O)NC |
| InChIKey | GYKXQTKSWLAUIT-UHFFFAOYSA-N |
Product Description
Applications: M-Cumenyl Methylcarbamate is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
M-Cumenyl Methylcarbamate is a agrochemical intermediate identified by CAS number 64-00-6 and the molecular formula C11H15NO2 and a molecular weight of 193.11 g/mol. Physically, the compound has a solubility: 10% in isophorone; 10% in xylene; 20% in toluene; 20% in toluene; 40% in isopropanol; 50% in acetone; 60% in dimethylformamide. Practically insoluble in cyclohexane. Synonyms include m-Cumenyl methylcarbamate and Hercules 5727.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of M-Cumenyl Methylcarbamate
Property Insights of M-Cumenyl Methylcarbamate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for M-Cumenyl Methylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, M-Cumenyl Methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, M-Cumenyl Methylcarbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of M-Cumenyl Methylcarbamate?
The CAS number of M-Cumenyl Methylcarbamate is 64-00-6.
What is the molecular formula of M-Cumenyl Methylcarbamate?
The molecular formula of M-Cumenyl Methylcarbamate is C11H15NO2.
What is the molecular weight of M-Cumenyl Methylcarbamate?
The molecular weight of M-Cumenyl Methylcarbamate is 193.11028 g/mol.
What are the applications of M-Cumenyl Methylcarbamate?
M-Cumenyl Methylcarbamate is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as...
Where can I buy M-Cumenyl Methylcarbamate?
You can request a quote for M-Cumenyl Methylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for M-Cumenyl Methylcarbamate?
Yes, CoreyChem provides custom synthesis services for M-Cumenyl Methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.