4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate
TL;DR: 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate (CAS 31035-92-4) is a chemical compound with molecular formula C14H24N2O4 and molecular weight 284.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate
Also Known As: 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate, But-2-yne-1,4-diyl bis(diethylcarbamate)
| Molecular Formula | C14H24N2O4 |
|---|---|
| Molecular Weight | 284.17 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 284.1736 |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 31035-92-4 |
|---|---|
| SMILES | CCN(CC)C(=O)OCC#CCOC(=O)N(CC)CC |
| InChIKey | NDTKHSIVDZRUDJ-UHFFFAOYSA-N |
Product Overview
4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate (CAS 31035-92-4), with molecular formula C14H24N2O4 and molecular weight 284.17 g/mol. IUPAC: 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate.
Chemical Property Profile of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate
Property Insights of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate. With a topological polar surface area (TPSA) of 59.1 Ų, 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate has 0 hydrogen bond donor(s) and 4 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 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate?
The CAS number of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate is 31035-92-4.
What is the molecular formula of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate?
The molecular formula of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate is C14H24N2O4.
What is the molecular weight of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate?
The molecular weight of 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate is 284.17 g/mol.
Where can I buy 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate?
You can request a quote for 4-(diethylcarbamoyloxy)but-2-ynyl 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 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-(diethylcarbamoyloxy)but-2-ynyl N,N-diethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.