1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate
TL;DR: 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate (CAS 25658-39-3) is a chemical compound with molecular formula C15H28N2O4 and molecular weight 300.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(ethylcarbamoyloxymethyl)-2-methylpentyl] N-[(E)-but-2-enyl]carbamate
Also Known As: 2-Methyl-2-propyl-1,3-propanediol 2-butenylcarbamate ethylcarbamate, 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate, (2-Butenyl)carbamic acid 2-(ethylcarbamoyloxymethyl)-2-methylpentyl ester, [2-(ethylcarbamoyloxymethyl)-2-methylpentyl] N-[(E)-but-2-enyl]carbamate, 2-{[(ethylcarbamoyl)oxy]methyl}-2-methylpentyl N-(but-2-en-1-yl)carbamate
| Molecular Formula | C15H28N2O4 |
|---|---|
| Molecular Weight | 300.20 g/mol |
| LogP | 2.8412 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 300.2049 |
| Heavy Atoms | 21 |
| Complexity | 344.5653 |
Chemical Identifiers
| CAS Number | 25658-39-3 |
|---|---|
| SMILES | CCCC(C)(COC(=O)NCC)COC(=O)NC/C=C/C |
Product Overview
1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate (CAS 25658-39-3), with molecular formula C15H28N2O4 and molecular weight 300.20 g/mol. IUPAC: [2-(ethylcarbamoyloxymethyl)-2-methylpentyl] N-[(E)-but-2-enyl]carbamate.
Chemical Property Profile of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate
Property Insights of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate
The XLogP value of 2.8412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate 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 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate?
The CAS number of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate is 25658-39-3.
What is the molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate?
The molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate is C15H28N2O4.
What is the molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate?
The molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate is 300.20 g/mol.
Where can I buy 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate?
You can request a quote for 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2-methyl-2-propyl-, 2-butenylcarbamate, ethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.