Ethyl N-(phenylcarbamothioyl)glycinate
TL;DR: Ethyl N-(phenylcarbamothioyl)glycinate (CAS 104892-69-5) is a chemical compound with molecular formula C11H14N2O2S and molecular weight 238.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(phenylcarbamothioylamino)acetate
Also Known As: ethyl 2-[(anilinocarbothioyl)amino]acetate, Ethyl 2-(3-phenylthioureido)acetate, ethyl 2-(phenylcarbamothioylamino)acetate, Ethyl [(anilinocarbonothioyl)amino]acetate, ethylanilinocarbothioylaminoacetate
Technical Specifications
| Molecular Formula | C11H14N2O2S |
| Molecular Weight | 238.0776 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.0776 Da |
| Heavy Atoms | 16 |
| Complexity | 240.0 |
| SMILES | CCOC(=O)CNC(=S)NC1=CC=CC=C1 |
| InChIKey | XMDBJTMVHHYSFG-UHFFFAOYSA-N |
Product Description
Applications: Ethyl N-(phenylcarbamothioyl)glycinate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Ethyl N-(phenylcarbamothioyl)glycinate is a fine chemical identified by CAS number 104892-69-5 and the molecular formula C11H14N2O2S and a molecular weight of 238.08 g/mol. Synonyms include ethyl 2-[(anilinocarbothioyl)amino]acetate and ACMC-1BSBC.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Ethyl N-(phenylcarbamothioyl)glycinate
Property Insights of Ethyl N-(phenylcarbamothioyl)glycinate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl N-(phenylcarbamothioyl)glycinate. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl N-(phenylcarbamothioyl)glycinate. Following Lipinski's Rule of Five, Ethyl N-(phenylcarbamothioyl)glycinate has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl N-(phenylcarbamothioyl)glycinate?
The CAS number of Ethyl N-(phenylcarbamothioyl)glycinate is 104892-69-5.
What is the molecular formula of Ethyl N-(phenylcarbamothioyl)glycinate?
The molecular formula of Ethyl N-(phenylcarbamothioyl)glycinate is C11H14N2O2S.
What is the molecular weight of Ethyl N-(phenylcarbamothioyl)glycinate?
The molecular weight of Ethyl N-(phenylcarbamothioyl)glycinate is 238.0776 g/mol.
What are the applications of Ethyl N-(phenylcarbamothioyl)glycinate?
Ethyl N-(phenylcarbamothioyl)glycinate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation...
Where can I buy Ethyl N-(phenylcarbamothioyl)glycinate?
You can request a quote for Ethyl N-(phenylcarbamothioyl)glycinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl N-(phenylcarbamothioyl)glycinate?
Yes, CoreyChem provides custom synthesis services for Ethyl N-(phenylcarbamothioyl)glycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.