Methyl N-butylcarbamate
TL;DR: Methyl N-butylcarbamate (CAS 2594-21-0) is a chemical compound with molecular formula C6H13NO2 and molecular weight 131.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-butylcarbamate
Also Known As: Methyl butylcarbamate, methyl N-butylcarbamate, BCME, Methylbutylcarbamate, METHYL N-n-BUTYLCARBAMATE
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H13NO2 |
| Molecular Weight | 131.09464 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 131.09464 Da |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
| SMILES | CCCCNC(=O)OC |
| InChIKey | NYVDNVCZHTXXMW-UHFFFAOYSA-N |
Chemical Property Profile of Methyl N-butylcarbamate
Property Insights of Methyl N-butylcarbamate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-butylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl N-butylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl N-butylcarbamate 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 Methyl N-butylcarbamate?
The CAS number of Methyl N-butylcarbamate is 2594-21-0.
What is the molecular formula of Methyl N-butylcarbamate?
The molecular formula of Methyl N-butylcarbamate is C6H13NO2.
What is the molecular weight of Methyl N-butylcarbamate?
The molecular weight of Methyl N-butylcarbamate is 131.09464 g/mol.
Where can I buy Methyl N-butylcarbamate?
You can request a quote for Methyl N-butylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl N-butylcarbamate?
Yes, CoreyChem provides custom synthesis services for Methyl N-butylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.