![5-[(2S)-2-aminobutyl]-2-methylphenol structure](/static/products/2234/223418-66-4.webp)
5-[(2S)-2-aminobutyl]-2-methylphenol
TL;DR: 5-[(2S)-2-aminobutyl]-2-methylphenol (CAS 223418-66-4) is a chemical compound with molecular formula C11H17NO and molecular weight 179.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2S)-2-aminobutyl]-2-methylphenol
Also Known As: 5-[(2S)-2-aminobutyl]-2-methylphenol, J1.768.644E, H75-12, (alphaS)-alpha-Ethyl-3-hydroxy-4-methylbenzeneethanamine
| Molecular Formula | C11H17NO |
|---|---|
| Molecular Weight | 179.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.13101 |
| Heavy Atoms | 13 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 223418-66-4 |
|---|---|
| SMILES | CC[C@@H](CC1=CC(=C(C=C1)C)O)N |
| InChIKey | ZPDWHORJHVKVPL-JTQLQIEISA-N |
Product Overview
5-[(2S)-2-aminobutyl]-2-methylphenol (CAS 223418-66-4), with molecular formula C11H17NO and molecular weight 179.13 g/mol. IUPAC: 5-[(2S)-2-aminobutyl]-2-methylphenol.
Chemical Property Profile of 5-[(2S)-2-aminobutyl]-2-methylphenol
Property Insights of 5-[(2S)-2-aminobutyl]-2-methylphenol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2S)-2-aminobutyl]-2-methylphenol. With a topological polar surface area (TPSA) of 46.3 Ų, 5-[(2S)-2-aminobutyl]-2-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(2S)-2-aminobutyl]-2-methylphenol 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 5-[(2S)-2-aminobutyl]-2-methylphenol?
The CAS number of 5-[(2S)-2-aminobutyl]-2-methylphenol is 223418-66-4.
What is the molecular formula of 5-[(2S)-2-aminobutyl]-2-methylphenol?
The molecular formula of 5-[(2S)-2-aminobutyl]-2-methylphenol is C11H17NO.
What is the molecular weight of 5-[(2S)-2-aminobutyl]-2-methylphenol?
The molecular weight of 5-[(2S)-2-aminobutyl]-2-methylphenol is 179.13 g/mol.
Where can I buy 5-[(2S)-2-aminobutyl]-2-methylphenol?
You can request a quote for 5-[(2S)-2-aminobutyl]-2-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2S)-2-aminobutyl]-2-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2S)-2-aminobutyl]-2-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.