1-乙基环己基氨基甲酸酯
TL;DR: 1-乙基环己基氨基甲酸酯 (CAS 64059-05-8) is a chemical compound with molecular formula C9H17NO2 and molecular weight 171.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-乙基环己基氨基甲酸酯
(1-ethylcyclohexyl) carbamate
Also Known As: 1-Ethylcyclohexyl carbamate, (1-ethylcyclohexyl) carbamate, 1-Ethylcyclohexyl=carbamate, CARBAMIC ACID, 1-ETHYLCYCLOHEXYL ESTER, Cyclohexanol, 1-ethyl-, carbamate
| Molecular Formula | C9H17NO2 |
|---|---|
| Molecular Weight | 171.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.12593 |
| Heavy Atoms | 12 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 64059-05-8 |
|---|---|
| SMILES | CCC1(CCCCC1)OC(=O)N |
| InChIKey | RGLAGNYFUKLAJX-UHFFFAOYSA-N |
Product Overview
1-乙基环己基氨基甲酸酯 (CAS 64059-05-8), with molecular formula C9H17NO2 and molecular weight 171.13 g/mol. IUPAC: (1-ethylcyclohexyl) carbamate.
Chemical Property Profile of 1-乙基环己基氨基甲酸酯
Property Insights of 1-乙基环己基氨基甲酸酯
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-乙基环己基氨基甲酸酯. With a topological polar surface area (TPSA) of 52.3 Ų, 1-乙基环己基氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-乙基环己基氨基甲酸酯 has 1 hydrogen bond donor(s) and 2 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 1-乙基环己基氨基甲酸酯?
The CAS number of 1-乙基环己基氨基甲酸酯 is 64059-05-8.
What is the molecular formula of 1-乙基环己基氨基甲酸酯?
The molecular formula of 1-乙基环己基氨基甲酸酯 is C9H17NO2.
What is the molecular weight of 1-乙基环己基氨基甲酸酯?
The molecular weight of 1-乙基环己基氨基甲酸酯 is 171.13 g/mol.
Where can I buy 1-乙基环己基氨基甲酸酯?
You can request a quote for 1-乙基环己基氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-乙基环己基氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 1-乙基环己基氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.