3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester
TL;DR: 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester (CAS 1144099-54-6) is a chemical compound with molecular formula C8H13NO2 and molecular weight 155.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-azabicyclo[3.1.0]hexane-6-carboxylate
Also Known As: Ethyl 3-azabicyclo[3.1.0]hexane-6-carboxylate, 3-AZABICYCLO[3.1.0]HEXANE-6-CARBOXYLIC ACID, ETHYL ESTER, 3-Azabicyclo[3.1.0]hexane-6-carboxylicacid,ethylester(9CI), ethyl 3-aza bicyclo[3.1.0]hexane-6-carboxylate, ethyl 3-aza-bicyclo[3.1.0]hexane-6-carboxylate
| Molecular Formula | C8H13NO2 |
|---|---|
| Molecular Weight | 155.09 g/mol |
| LogP | 0.0149 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 155.09464 |
| Heavy Atoms | 11 |
| Complexity | 170.93088 |
Chemical Identifiers
| CAS Number | 1144099-54-6 |
|---|---|
| SMILES | CCOC(=O)C1C2C1CNC2 |
Product Overview
3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester (CAS 1144099-54-6), with molecular formula C8H13NO2 and molecular weight 155.09 g/mol. IUPAC: ethyl 3-azabicyclo[3.1.0]hexane-6-carboxylate.
Chemical Property Profile of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester
Property Insights of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester
The XLogP value of 0.0149 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester. With a topological polar surface area (TPSA) of 38.33 Ų, 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester 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 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester?
The CAS number of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester is 1144099-54-6.
What is the molecular formula of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester?
The molecular formula of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester is C8H13NO2.
What is the molecular weight of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester?
The molecular weight of 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester is 155.09 g/mol.
Where can I buy 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester?
You can request a quote for 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Azabicyclo(3.1.0)hexane-6-carboxylic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.