N-(1-phenylethyl)butan-2-amine
TL;DR: N-(1-phenylethyl)butan-2-amine (CAS 25102-88-9) is a chemical compound with molecular formula C12H19N and molecular weight 177.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-phenylethyl)butan-2-amine
Also Known As: N-(1-phenylethyl)butan-2-amine, (butan-2-yl)(1-phenylethyl)amine, (methylpropyl)(phenylethyl)amine, sec-Butyl(alpha-methylbenzyl)amine, J1.179.005D
| Molecular Formula | C12H19N |
|---|---|
| Molecular Weight | 177.15 g/mol |
| LogP | 3.1357 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.15175 |
| Heavy Atoms | 13 |
| Complexity | 230.1396 |
Chemical Identifiers
| CAS Number | 25102-88-9 |
|---|---|
| SMILES | CCC(C)NC(C)C1=CC=CC=C1 |
Product Overview
N-(1-phenylethyl)butan-2-amine (CAS 25102-88-9), with molecular formula C12H19N and molecular weight 177.15 g/mol. IUPAC: N-(1-phenylethyl)butan-2-amine.
Chemical Property Profile of N-(1-phenylethyl)butan-2-amine
Property Insights of N-(1-phenylethyl)butan-2-amine
The XLogP value of 3.1357 indicates that N-(1-phenylethyl)butan-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, N-(1-phenylethyl)butan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-phenylethyl)butan-2-amine 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 N-(1-phenylethyl)butan-2-amine?
The CAS number of N-(1-phenylethyl)butan-2-amine is 25102-88-9.
What is the molecular formula of N-(1-phenylethyl)butan-2-amine?
The molecular formula of N-(1-phenylethyl)butan-2-amine is C12H19N.
What is the molecular weight of N-(1-phenylethyl)butan-2-amine?
The molecular weight of N-(1-phenylethyl)butan-2-amine is 177.15 g/mol.
Where can I buy N-(1-phenylethyl)butan-2-amine?
You can request a quote for N-(1-phenylethyl)butan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-phenylethyl)butan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-phenylethyl)butan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.