3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate
TL;DR: 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate (CAS 96804-64-7) is a chemical compound with molecular formula C9H19N3O3 and molecular weight 217.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[dimethylamino(methylcarbamoyl)amino]propanoate
Also Known As: 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate, Ethyl 3-(2,2-dimethyl-1-((methylamino)carbonyl)hydrazino)propanoate, Propanoic acid, 3-(2,2-dimethyl-1-((methylamino)carbonyl)hydrazino)-, ethyl ester, ethyl 3-[dimethylamino(methylcarbamoyl)amino]propanoate, Ethyl 3-[2,2-dimethyl-1-(methylcarbamoyl)hydrazin-1-yl]propanoate
| Molecular Formula | C9H19N3O3 |
|---|---|
| Molecular Weight | 217.14 g/mol |
| LogP | 0.0576 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 217.14264 |
| Heavy Atoms | 15 |
| Complexity | 218.6481 |
Chemical Identifiers
| CAS Number | 96804-64-7 |
|---|---|
| SMILES | CCOC(=O)CCN(C(=O)NC)N(C)C |
Product Overview
3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate (CAS 96804-64-7), with molecular formula C9H19N3O3 and molecular weight 217.14 g/mol. IUPAC: ethyl 3-[dimethylamino(methylcarbamoyl)amino]propanoate.
Chemical Property Profile of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate
Property Insights of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate
The XLogP value of 0.0576 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate. Following Lipinski's Rule of Five, 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate 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 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate?
The CAS number of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate is 96804-64-7.
What is the molecular formula of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate?
The molecular formula of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate is C9H19N3O3.
What is the molecular weight of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate?
The molecular weight of 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate is 217.14 g/mol.
Where can I buy 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate?
You can request a quote for 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,2-Dimethyl-1-methylcarbamoylhydrazino)ethylpropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.