Ethyl decylcarbamate
TL;DR: Ethyl decylcarbamate (CAS 45176-17-8) is a chemical compound with molecular formula C13H27NO2 and molecular weight 229.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-decylcarbamate
Also Known As: Ethyl decylcarbamate, ethyl N-decylcarbamate, Decylcarbamic acid ethyl ester, J1.674.120E
| Molecular Formula | C13H27NO2 |
|---|---|
| Molecular Weight | 229.20 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 229.20418 |
| Heavy Atoms | 16 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 45176-17-8 |
|---|---|
| SMILES | CCCCCCCCCCNC(=O)OCC |
| InChIKey | VEPXHJBBERABON-UHFFFAOYSA-N |
Product Overview
Ethyl decylcarbamate (CAS 45176-17-8), with molecular formula C13H27NO2 and molecular weight 229.20 g/mol. IUPAC: ethyl N-decylcarbamate.
Chemical Property Profile of Ethyl decylcarbamate
Property Insights of Ethyl decylcarbamate
The XLogP value of 4.8 indicates that Ethyl decylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl decylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl decylcarbamate 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
Frequently Asked Questions
What is the CAS number of Ethyl decylcarbamate?
The CAS number of Ethyl decylcarbamate is 45176-17-8.
What is the molecular formula of Ethyl decylcarbamate?
The molecular formula of Ethyl decylcarbamate is C13H27NO2.
What is the molecular weight of Ethyl decylcarbamate?
The molecular weight of Ethyl decylcarbamate is 229.20 g/mol.
Where can I buy Ethyl decylcarbamate?
You can request a quote for Ethyl decylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl decylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl decylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.