(S)-dodecyl 2-amino-3-methylbutanoate
TL;DR: (S)-dodecyl 2-amino-3-methylbutanoate (CAS 52207-50-8) is a chemical compound with molecular formula C17H35NO2 and molecular weight 285.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecyl (2S)-2-amino-3-methylbutanoate
Also Known As: dodecyl l-valinate, L-Valine, dodecyl ester, L-Valine dodecyl ester, (S)-dodecyl 2-amino-3-methylbutanoate, Dodecyl 2-amino-3-methyl-butanoate
| Molecular Formula | C17H35NO2 |
|---|---|
| Molecular Weight | 285.27 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 285.26678 |
| Heavy Atoms | 20 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 52207-50-8 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)[C@H](C(C)C)N |
| InChIKey | ZPAXKQNZIUNMHH-INIZCTEOSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-dodecyl 2-amino-3-methylbutanoate (CAS 52207-50-8), with molecular formula C17H35NO2 and molecular weight 285.27 g/mol. IUPAC: dodecyl (2S)-2-amino-3-methylbutanoate.
Chemical Property Profile of (S)-dodecyl 2-amino-3-methylbutanoate
Property Insights of (S)-dodecyl 2-amino-3-methylbutanoate
The XLogP value of 6.2 indicates that (S)-dodecyl 2-amino-3-methylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, (S)-dodecyl 2-amino-3-methylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-dodecyl 2-amino-3-methylbutanoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-dodecyl 2-amino-3-methylbutanoate?
The CAS number of (S)-dodecyl 2-amino-3-methylbutanoate is 52207-50-8.
What is the molecular formula of (S)-dodecyl 2-amino-3-methylbutanoate?
The molecular formula of (S)-dodecyl 2-amino-3-methylbutanoate is C17H35NO2.
What is the molecular weight of (S)-dodecyl 2-amino-3-methylbutanoate?
The molecular weight of (S)-dodecyl 2-amino-3-methylbutanoate is 285.27 g/mol.
Where can I buy (S)-dodecyl 2-amino-3-methylbutanoate?
You can request a quote for (S)-dodecyl 2-amino-3-methylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-dodecyl 2-amino-3-methylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-dodecyl 2-amino-3-methylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.