二乙基亚甲基二氨基甲酸酯
TL;DR: 二乙基亚甲基二氨基甲酸酯 (CAS 3693-53-6) is a chemical compound with molecular formula C7H14N2O4 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二乙基亚甲基二氨基甲酸酯
ethyl N-[(ethoxycarbonylamino)methyl]carbamate
Also Known As: Methylene diurethane, Diethyl methylenedicarbamate, Methylenediurethane, Methylene diurethan, Methylene bisurethane
| Molecular Formula | C7H14N2O4 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 190.09535 |
| Heavy Atoms | 13 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 3693-53-6 |
|---|---|
| SMILES | CCOC(=O)NCNC(=O)OCC |
| InChIKey | QSPOJWMZYOMAEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二乙基亚甲基二氨基甲酸酯 (CAS 3693-53-6), with molecular formula C7H14N2O4 and molecular weight 190.10 g/mol. IUPAC: ethyl N-[(ethoxycarbonylamino)methyl]carbamate.
Chemical Property Profile of 二乙基亚甲基二氨基甲酸酯
Property Insights of 二乙基亚甲基二氨基甲酸酯
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二乙基亚甲基二氨基甲酸酯. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 二乙基亚甲基二氨基甲酸酯. Following Lipinski's Rule of Five, 二乙基亚甲基二氨基甲酸酯 has 2 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 二乙基亚甲基二氨基甲酸酯?
The CAS number of 二乙基亚甲基二氨基甲酸酯 is 3693-53-6.
What is the molecular formula of 二乙基亚甲基二氨基甲酸酯?
The molecular formula of 二乙基亚甲基二氨基甲酸酯 is C7H14N2O4.
What is the molecular weight of 二乙基亚甲基二氨基甲酸酯?
The molecular weight of 二乙基亚甲基二氨基甲酸酯 is 190.10 g/mol.
Where can I buy 二乙基亚甲基二氨基甲酸酯?
You can request a quote for 二乙基亚甲基二氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二乙基亚甲基二氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 二乙基亚甲基二氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.