1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate
TL;DR: 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate (CAS 25385-26-6) is a chemical compound with molecular formula C14H24N2O4 and molecular weight 284.1736 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(carbamoyloxymethyl)-2-ethylhexyl] N-prop-2-ynylcarbamate
Also Known As: 2-Butyl-2-ethyl-1,3-propanediol carbamate 2-propynylcarbamate, 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate, 2-[(carbamoyloxy)methyl]-2-ethylhexyl prop-2-yn-1-ylcarbamate, [2-(carbamoyloxymethyl)-2-ethylhexyl] N-prop-2-ynylcarbamate, N-Propin-(2)-yl-2-ethyl-2-butyl-1,3-dicarbamoyloxy-propan
Technical Specifications
| Molecular Formula | C14H24N2O4 |
| Molecular Weight | 284.1736 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 284.1736 Da |
| Heavy Atoms | 20 |
| Complexity | 361.0 |
| SMILES | CCCCC(CC)(COC(=O)N)COC(=O)NCC#C |
| InChIKey | KQFSLSHCXZRAJU-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate
Property Insights of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate 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
What is the CAS number of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate?
The CAS number of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate is 25385-26-6.
What is the molecular formula of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate?
The molecular formula of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate is C14H24N2O4.
What is the molecular weight of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate?
The molecular weight of 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate is 284.1736 g/mol.
Where can I buy 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate?
You can request a quote for 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate?
Yes, CoreyChem provides custom synthesis services for 1,3-Propanediol, 2-butyl-2-ethyl-, carbamate, 2-propynylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.