Ethyl 1-(hydroxymethyl)-propylcarbamate
TL;DR: Ethyl 1-(hydroxymethyl)-propylcarbamate (CAS 51170-48-0) is a chemical compound with molecular formula C7H15NO3 and molecular weight 161.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(1-hydroxybutan-2-yl)carbamate
Also Known As: ETHYL 1-(HYDROXYMETHYL)-PROPYLCARBAMATE, ethyl N-(1-hydroxybutan-2-yl)carbamate, ETHYL-1- PROPYLCARBAMATE, ethyl (1-hydroxybutan-2-yl)carbamate, ethyl 1-ethyl-2-hydroxy-ethylcarbamate
| Molecular Formula | C7H15NO3 |
|---|---|
| Molecular Weight | 161.11 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 161.1052 |
| Heavy Atoms | 11 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 51170-48-0 |
|---|---|
| SMILES | CCC(CO)NC(=O)OCC |
| InChIKey | NWXGDPDBQOTZRZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 1-(hydroxymethyl)-propylcarbamate (CAS 51170-48-0), with molecular formula C7H15NO3 and molecular weight 161.11 g/mol. IUPAC: ethyl N-(1-hydroxybutan-2-yl)carbamate.
Chemical Property Profile of Ethyl 1-(hydroxymethyl)-propylcarbamate
Property Insights of Ethyl 1-(hydroxymethyl)-propylcarbamate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(hydroxymethyl)-propylcarbamate. With a topological polar surface area (TPSA) of 58.6 Ų, Ethyl 1-(hydroxymethyl)-propylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-(hydroxymethyl)-propylcarbamate 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
Frequently Asked Questions
What is the CAS number of Ethyl 1-(hydroxymethyl)-propylcarbamate?
The CAS number of Ethyl 1-(hydroxymethyl)-propylcarbamate is 51170-48-0.
What is the molecular formula of Ethyl 1-(hydroxymethyl)-propylcarbamate?
The molecular formula of Ethyl 1-(hydroxymethyl)-propylcarbamate is C7H15NO3.
What is the molecular weight of Ethyl 1-(hydroxymethyl)-propylcarbamate?
The molecular weight of Ethyl 1-(hydroxymethyl)-propylcarbamate is 161.11 g/mol.
Where can I buy Ethyl 1-(hydroxymethyl)-propylcarbamate?
You can request a quote for Ethyl 1-(hydroxymethyl)-propylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-(hydroxymethyl)-propylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(hydroxymethyl)-propylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.