Butylethanolamine
TL;DR: Butylethanolamine (CAS 111-75-1) is a chemical compound with molecular formula C6H15NO and molecular weight 117.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(butylamino)ethanol
Also Known As: 2-(Butylamino)ethanol, 2-Butylaminoethanol, N-Butylethanolamine, Butylethanolamine, n-Butylaminoethanol
| Molecular Formula | C6H15NO |
|---|---|
| Molecular Weight | 117.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 117.115364 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 111-75-1 |
|---|---|
| SMILES | CCCCNCCO |
| InChIKey | LJDSTRZHPWMDPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butylethanolamine (CAS 111-75-1), with molecular formula C6H15NO and molecular weight 117.12 g/mol. IUPAC: 2-(butylamino)ethanol.
Chemical Property Profile of Butylethanolamine
Property Insights of Butylethanolamine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butylethanolamine. With a topological polar surface area (TPSA) of 32.3 Ų, Butylethanolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butylethanolamine has 2 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 Butylethanolamine?
The CAS number of Butylethanolamine is 111-75-1.
What is the molecular formula of Butylethanolamine?
The molecular formula of Butylethanolamine is C6H15NO.
What is the molecular weight of Butylethanolamine?
The molecular weight of Butylethanolamine is 117.12 g/mol.
Where can I buy Butylethanolamine?
You can request a quote for Butylethanolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butylethanolamine?
Yes, KEHONG BIO provides custom synthesis services for Butylethanolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.