Ethyl (1-aminocyclohexyl)acetate
TL;DR: Ethyl (1-aminocyclohexyl)acetate (CAS 696645-77-9) is a chemical compound with molecular formula C10H19NO2 and molecular weight 185.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-aminocyclohexyl)acetate
Also Known As: ethyl (1-aminocyclohexyl)acetate, ethyl 2-(1-aminocyclohexyl)acetate, ChemDiv2_003496, (1-Amino-cyclohexyl)-acetic acid ethyl ester, (1-Aminocyclohexyl)acetic acid ethyl ester
| Molecular Formula | C10H19NO2 |
|---|---|
| Molecular Weight | 185.14 g/mol |
| LogP | 1.6012 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.14159 |
| Heavy Atoms | 13 |
| Complexity | 173.76357 |
Chemical Identifiers
| CAS Number | 696645-77-9 |
|---|---|
| SMILES | CCOC(=O)CC1(CCCCC1)N |
Product Overview
Ethyl (1-aminocyclohexyl)acetate (CAS 696645-77-9), with molecular formula C10H19NO2 and molecular weight 185.14 g/mol. IUPAC: ethyl 2-(1-aminocyclohexyl)acetate.
Chemical Property Profile of Ethyl (1-aminocyclohexyl)acetate
Property Insights of Ethyl (1-aminocyclohexyl)acetate
The XLogP value of 1.6012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (1-aminocyclohexyl)acetate. With a topological polar surface area (TPSA) of 52.32 Ų, Ethyl (1-aminocyclohexyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (1-aminocyclohexyl)acetate 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 (1-aminocyclohexyl)acetate?
The CAS number of Ethyl (1-aminocyclohexyl)acetate is 696645-77-9.
What is the molecular formula of Ethyl (1-aminocyclohexyl)acetate?
The molecular formula of Ethyl (1-aminocyclohexyl)acetate is C10H19NO2.
What is the molecular weight of Ethyl (1-aminocyclohexyl)acetate?
The molecular weight of Ethyl (1-aminocyclohexyl)acetate is 185.14 g/mol.
Where can I buy Ethyl (1-aminocyclohexyl)acetate?
You can request a quote for Ethyl (1-aminocyclohexyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (1-aminocyclohexyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (1-aminocyclohexyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.