Ethyl formylcarbamate
TL;DR: Ethyl formylcarbamate (CAS 18804-91-6) is a chemical compound with molecular formula C4H7NO3 and molecular weight 117.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-formylcarbamate
Also Known As: ethyl formylcarbamate, Formyl-urethan, ethyl N-formylcarbamate, ethylformylcarbamate, formyl-carbamic acid ethyl ester
| Molecular Formula | C4H7NO3 |
|---|---|
| Molecular Weight | 117.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 117.042595 |
| Heavy Atoms | 8 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 18804-91-6 |
|---|---|
| SMILES | CCOC(=O)NC=O |
| InChIKey | FOIOWCBPOAJVPZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl formylcarbamate (CAS 18804-91-6), with molecular formula C4H7NO3 and molecular weight 117.04 g/mol. IUPAC: ethyl N-formylcarbamate.
Chemical Property Profile of Ethyl formylcarbamate
Property Insights of Ethyl formylcarbamate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl formylcarbamate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl formylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl formylcarbamate has 1 hydrogen bond donor(s) and 3 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 Ethyl formylcarbamate?
The CAS number of Ethyl formylcarbamate is 18804-91-6.
What is the molecular formula of Ethyl formylcarbamate?
The molecular formula of Ethyl formylcarbamate is C4H7NO3.
What is the molecular weight of Ethyl formylcarbamate?
The molecular weight of Ethyl formylcarbamate is 117.04 g/mol.
Where can I buy Ethyl formylcarbamate?
You can request a quote for Ethyl formylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl formylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl formylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.