(3-methylphenyl)methyl N,N-diethylcarbamate
TL;DR: (3-methylphenyl)methyl N,N-diethylcarbamate (CAS 93759-64-9) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methylphenyl)methyl N,N-diethylcarbamate
Also Known As: 3-methylbenzyl diethylcarbamate, (3-methylphenyl)methyl N,N-diethylcarbamate, (3-Methylphenyl)methyl diethylcarbamate
| Molecular Formula | C13H19NO2 |
|---|---|
| Molecular Weight | 221.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.14159 |
| Heavy Atoms | 16 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 93759-64-9 |
|---|---|
| SMILES | CCN(CC)C(=O)OCC1=CC=CC(=C1)C |
| InChIKey | LIQRXDMSPRCYBJ-UHFFFAOYSA-N |
Product Overview
(3-methylphenyl)methyl N,N-diethylcarbamate (CAS 93759-64-9), with molecular formula C13H19NO2 and molecular weight 221.14 g/mol. IUPAC: (3-methylphenyl)methyl N,N-diethylcarbamate.
Chemical Property Profile of (3-methylphenyl)methyl N,N-diethylcarbamate
Property Insights of (3-methylphenyl)methyl N,N-diethylcarbamate
The XLogP value of 3.3 indicates that (3-methylphenyl)methyl N,N-diethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, (3-methylphenyl)methyl N,N-diethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-methylphenyl)methyl N,N-diethylcarbamate 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 (3-methylphenyl)methyl N,N-diethylcarbamate?
The CAS number of (3-methylphenyl)methyl N,N-diethylcarbamate is 93759-64-9.
What is the molecular formula of (3-methylphenyl)methyl N,N-diethylcarbamate?
The molecular formula of (3-methylphenyl)methyl N,N-diethylcarbamate is C13H19NO2.
What is the molecular weight of (3-methylphenyl)methyl N,N-diethylcarbamate?
The molecular weight of (3-methylphenyl)methyl N,N-diethylcarbamate is 221.14 g/mol.
Where can I buy (3-methylphenyl)methyl N,N-diethylcarbamate?
You can request a quote for (3-methylphenyl)methyl N,N-diethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-methylphenyl)methyl N,N-diethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for (3-methylphenyl)methyl N,N-diethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.