But-2-yne-1,4-diyl bis(methylcarbamate)
TL;DR: But-2-yne-1,4-diyl bis(methylcarbamate) (CAS 57024-73-4) is a chemical compound with molecular formula C8H12N2O4 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(methylcarbamoyloxy)but-2-ynyl N-methylcarbamate
Also Known As: camphor enol trimethylsilyl ether, but-2-yne-1,4-diyl bis(methylcarbamate), 4-(methylcarbamoyloxy)but-2-ynyl N-methylcarbamate, 2-Butyne-1,4-diol,bis(methylcarbamate) (9CI)
| Molecular Formula | C8H12N2O4 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.07971 |
| Heavy Atoms | 14 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 57024-73-4 |
|---|---|
| SMILES | CNC(=O)OCC#CCOC(=O)NC |
| InChIKey | JDZIEGPGDJDZSB-UHFFFAOYSA-N |
Product Overview
But-2-yne-1,4-diyl bis(methylcarbamate) (CAS 57024-73-4), with molecular formula C8H12N2O4 and molecular weight 200.08 g/mol. IUPAC: 4-(methylcarbamoyloxy)but-2-ynyl N-methylcarbamate.
Chemical Property Profile of But-2-yne-1,4-diyl bis(methylcarbamate)
Property Insights of But-2-yne-1,4-diyl bis(methylcarbamate)
The XLogP value of -0.3 indicates that But-2-yne-1,4-diyl bis(methylcarbamate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for But-2-yne-1,4-diyl bis(methylcarbamate). Following Lipinski's Rule of Five, But-2-yne-1,4-diyl bis(methylcarbamate) has 2 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 But-2-yne-1,4-diyl bis(methylcarbamate)?
The CAS number of But-2-yne-1,4-diyl bis(methylcarbamate) is 57024-73-4.
What is the molecular formula of But-2-yne-1,4-diyl bis(methylcarbamate)?
The molecular formula of But-2-yne-1,4-diyl bis(methylcarbamate) is C8H12N2O4.
What is the molecular weight of But-2-yne-1,4-diyl bis(methylcarbamate)?
The molecular weight of But-2-yne-1,4-diyl bis(methylcarbamate) is 200.08 g/mol.
Where can I buy But-2-yne-1,4-diyl bis(methylcarbamate)?
You can request a quote for But-2-yne-1,4-diyl bis(methylcarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for But-2-yne-1,4-diyl bis(methylcarbamate)?
Yes, KEHONG BIO provides custom synthesis services for But-2-yne-1,4-diyl bis(methylcarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.