Methyl butylmethylcarbamate
TL;DR: Methyl butylmethylcarbamate (CAS 54644-60-9) is a chemical compound with molecular formula C7H15NO2 and molecular weight 145.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-butyl-N-methylcarbamate
Also Known As: Methyl butylmethylcarbamate, methyl N-butyl-N-methylcarbamate, Butylmethylcarbamicacidmethylester, Butylmethylcarbamic acid methyl ester, Carbamic acid, butylmethyl-, methyl ester
| Molecular Formula | C7H15NO2 |
|---|---|
| Molecular Weight | 145.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 145.11028 |
| Heavy Atoms | 10 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 54644-60-9 |
|---|---|
| SMILES | CCCCN(C)C(=O)OC |
| InChIKey | NAYDYXLJOVNQPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl butylmethylcarbamate (CAS 54644-60-9), with molecular formula C7H15NO2 and molecular weight 145.11 g/mol. IUPAC: methyl N-butyl-N-methylcarbamate.
Chemical Property Profile of Methyl butylmethylcarbamate
Property Insights of Methyl butylmethylcarbamate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl butylmethylcarbamate. With a topological polar surface area (TPSA) of 29.5 Ų, Methyl butylmethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl butylmethylcarbamate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl butylmethylcarbamate?
The CAS number of Methyl butylmethylcarbamate is 54644-60-9.
What is the molecular formula of Methyl butylmethylcarbamate?
The molecular formula of Methyl butylmethylcarbamate is C7H15NO2.
What is the molecular weight of Methyl butylmethylcarbamate?
The molecular weight of Methyl butylmethylcarbamate is 145.11 g/mol.
Where can I buy Methyl butylmethylcarbamate?
You can request a quote for Methyl butylmethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl butylmethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl butylmethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.