Butyl N-(trifluoroacetyl)-alpha-aminobutyrate
TL;DR: Butyl N-(trifluoroacetyl)-alpha-aminobutyrate (CAS 34815-09-3) is a chemical compound with molecular formula C10H16F3NO3 and molecular weight 255.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-[(2,2,2-trifluoroacetyl)amino]butanoate
Also Known As: butyl 2-(2,2,2-trifluoroacetamido)butanoate, Butyl 2-[(trifluoroacetyl)amino]butanoate, Butyl N-(trifluoroacetyl)-.alpha.-aminobutyrate, Butyl 2-[(trifluoroacetyl)amino]butanoate #, 2-[(Trifluoroacetyl)amino]butanoic acid butyl ester
| Molecular Formula | C10H16F3NO3 |
|---|---|
| Molecular Weight | 255.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 255.10823 |
| Heavy Atoms | 17 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 34815-09-3 |
|---|---|
| SMILES | CCCCOC(=O)C(CC)NC(=O)C(F)(F)F |
| InChIKey | NCHKTZGLBUCPRF-UHFFFAOYSA-N |
Product Overview
Butyl N-(trifluoroacetyl)-alpha-aminobutyrate (CAS 34815-09-3), with molecular formula C10H16F3NO3 and molecular weight 255.11 g/mol. IUPAC: butyl 2-[(2,2,2-trifluoroacetyl)amino]butanoate.
Chemical Property Profile of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate
Property Insights of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl N-(trifluoroacetyl)-alpha-aminobutyrate. With a topological polar surface area (TPSA) of 55.4 Ų, Butyl N-(trifluoroacetyl)-alpha-aminobutyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl N-(trifluoroacetyl)-alpha-aminobutyrate has 1 hydrogen bond donor(s) and 6 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 Butyl N-(trifluoroacetyl)-alpha-aminobutyrate?
The CAS number of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate is 34815-09-3.
What is the molecular formula of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate?
The molecular formula of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate is C10H16F3NO3.
What is the molecular weight of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate?
The molecular weight of Butyl N-(trifluoroacetyl)-alpha-aminobutyrate is 255.11 g/mol.
Where can I buy Butyl N-(trifluoroacetyl)-alpha-aminobutyrate?
You can request a quote for Butyl N-(trifluoroacetyl)-alpha-aminobutyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl N-(trifluoroacetyl)-alpha-aminobutyrate?
Yes, KEHONG BIO provides custom synthesis services for Butyl N-(trifluoroacetyl)-alpha-aminobutyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.