Benzeneethanamine, alpha-(1-methylethyl)-
TL;DR: Benzeneethanamine, alpha-(1-methylethyl)- (CAS 97589-56-5) is a chemical compound with molecular formula C11H17N and molecular weight 163.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-1-phenylbutan-2-amine
Also Known As: Benzeneethanamine, alpha-(1-methylethyl)-, (2S)-3-methyl-1-phenylbutan-2-amine, (2S)-3-methyl-1-phenyl-butan-2-amine, alpha-(1-Methylethyl)benzeneethanamine, 2-amino-1-phenyl-3-methylbutane
| Molecular Formula | C11H17N |
|---|---|
| Molecular Weight | 163.14 g/mol |
| LogP | 2.2124 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.1361 |
| Heavy Atoms | 12 |
| Complexity | 215.70554 |
Chemical Identifiers
| CAS Number | 97589-56-5 |
|---|---|
| SMILES | CC(C)[C@H](CC1=CC=CC=C1)N |
Product Overview
Benzeneethanamine, alpha-(1-methylethyl)- (CAS 97589-56-5), with molecular formula C11H17N and molecular weight 163.14 g/mol. IUPAC: (2S)-3-methyl-1-phenylbutan-2-amine.
Chemical Property Profile of Benzeneethanamine, alpha-(1-methylethyl)-
Property Insights of Benzeneethanamine, alpha-(1-methylethyl)-
The XLogP value of 2.2124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneethanamine, alpha-(1-methylethyl)-. With a topological polar surface area (TPSA) of 26.02 Ų, Benzeneethanamine, alpha-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanamine, alpha-(1-methylethyl)- has 1 hydrogen bond donor(s) and 1 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 Benzeneethanamine, alpha-(1-methylethyl)-?
The CAS number of Benzeneethanamine, alpha-(1-methylethyl)- is 97589-56-5.
What is the molecular formula of Benzeneethanamine, alpha-(1-methylethyl)-?
The molecular formula of Benzeneethanamine, alpha-(1-methylethyl)- is C11H17N.
What is the molecular weight of Benzeneethanamine, alpha-(1-methylethyl)-?
The molecular weight of Benzeneethanamine, alpha-(1-methylethyl)- is 163.14 g/mol.
Where can I buy Benzeneethanamine, alpha-(1-methylethyl)-?
You can request a quote for Benzeneethanamine, alpha-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, alpha-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, alpha-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.