![(2S)-N-[(1S)-1-phenylethyl]butan-2-amine structure](/static/products/860/86013-68-5.png)
(2S)-N-[(1S)-1-phenylethyl]butan-2-amine
TL;DR: (2S)-N-[(1S)-1-phenylethyl]butan-2-amine (CAS 86013-68-5) 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.
(2S)-N-[(1S)-1-phenylethyl]butan-2-amine
Also Known As: (S,S)-N-sec-butyl-alpha-phenylethylamine, (2S)-N-[(1S)-1-phenylethyl]butan-2-amine
| 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 | 86013-68-5 |
|---|---|
| SMILES | CC[C@H](C)N[C@@H](C)C1=CC=CC=C1 |
Product Overview
(2S)-N-[(1S)-1-phenylethyl]butan-2-amine (CAS 86013-68-5), with molecular formula C12H19N and molecular weight 177.15 g/mol. IUPAC: (2S)-N-[(1S)-1-phenylethyl]butan-2-amine.
Chemical Property Profile of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine
Property Insights of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine
The XLogP value of 3.1357 indicates that (2S)-N-[(1S)-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, (2S)-N-[(1S)-1-phenylethyl]butan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-N-[(1S)-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 (2S)-N-[(1S)-1-phenylethyl]butan-2-amine?
The CAS number of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine is 86013-68-5.
What is the molecular formula of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine?
The molecular formula of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine is C12H19N.
What is the molecular weight of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine?
The molecular weight of (2S)-N-[(1S)-1-phenylethyl]butan-2-amine is 177.15 g/mol.
Where can I buy (2S)-N-[(1S)-1-phenylethyl]butan-2-amine?
You can request a quote for (2S)-N-[(1S)-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 (2S)-N-[(1S)-1-phenylethyl]butan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for (2S)-N-[(1S)-1-phenylethyl]butan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.