苯甲酰氧基氨基甲酸乙酯
TL;DR: 苯甲酰氧基氨基甲酸乙酯 (CAS 64596-18-5) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯甲酰氧基氨基甲酸乙酯
(ethoxycarbonylamino) benzoate
Also Known As: (ethoxycarbonylamino) benzoate, ethyl (benzoyloxy)carbamate, Carbamic acid, (benzoyloxy)-, ethyl ester, carbamic acid,(benzoyloxy)-,ethyl ester
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 64596-18-5 |
|---|---|
| SMILES | CCOC(=O)NOC(=O)C1=CC=CC=C1 |
| InChIKey | MGDRMYZKZHHUMV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯甲酰氧基氨基甲酸乙酯 (CAS 64596-18-5), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: (ethoxycarbonylamino) benzoate.
Chemical Property Profile of 苯甲酰氧基氨基甲酸乙酯
Property Insights of 苯甲酰氧基氨基甲酸乙酯
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯甲酰氧基氨基甲酸乙酯. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 苯甲酰氧基氨基甲酸乙酯. Following Lipinski's Rule of Five, 苯甲酰氧基氨基甲酸乙酯 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 苯甲酰氧基氨基甲酸乙酯?
The CAS number of 苯甲酰氧基氨基甲酸乙酯 is 64596-18-5.
What is the molecular formula of 苯甲酰氧基氨基甲酸乙酯?
The molecular formula of 苯甲酰氧基氨基甲酸乙酯 is C10H11NO4.
What is the molecular weight of 苯甲酰氧基氨基甲酸乙酯?
The molecular weight of 苯甲酰氧基氨基甲酸乙酯 is 209.07 g/mol.
Where can I buy 苯甲酰氧基氨基甲酸乙酯?
You can request a quote for 苯甲酰氧基氨基甲酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯甲酰氧基氨基甲酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 苯甲酰氧基氨基甲酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.