1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate
TL;DR: 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate (CAS 25648-96-8) is a chemical compound with molecular formula C13H26N2O4 and molecular weight 274.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(ethylcarbamoyloxymethyl)-2-methylpentyl] N,N-dimethylcarbamate
Also Known As: 2-Methyl-2-propyl-1,3-propanediol dimethylcarbamate ethylcarbamate, 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate, 2-{[(dimethylcarbamoyl)oxy]methyl}-2-methylpentyl ethylcarbamate, N.N.2-Trimethyl-N'-ethyl-2-propyl-1.3-dicarbamoyloxy-propan, [2-(ethylcarbamoyloxymethyl)-2-methylpentyl] N,N-dimethylcarbamate
| Molecular Formula | C13H26N2O4 |
|---|---|
| Molecular Weight | 274.19 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 274.18927 |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 25648-96-8 |
|---|---|
| SMILES | CCCC(C)(COC(=O)NCC)COC(=O)N(C)C |
| InChIKey | FJFRCZLGKLPJHB-UHFFFAOYSA-N |
Product Overview
1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate (CAS 25648-96-8), with molecular formula C13H26N2O4 and molecular weight 274.19 g/mol. IUPAC: [2-(ethylcarbamoyloxymethyl)-2-methylpentyl] N,N-dimethylcarbamate.
Chemical Property Profile of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate
Property Insights of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate has 1 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-, dimethylcarbamate, ethylcarbamate?
The CAS number of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate is 25648-96-8.
What is the molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate?
The molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate is C13H26N2O4.
What is the molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate?
The molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate is 274.19 g/mol.
Where can I buy 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate?
You can request a quote for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, 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-, dimethylcarbamate, ethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2-methyl-2-propyl-, dimethylcarbamate, ethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.