Tert-butyl 2-hydroxybutanoate
TL;DR: Tert-butyl 2-hydroxybutanoate (CAS 110171-06-7) is a chemical compound with molecular formula C8H16O3 and molecular weight 160.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-hydroxybutanoate
Also Known As: Tert-butyl 2-hydroxybutanoate, tert-Butyl (R)-2-hydroxybutyrate, (R)-tert-Butyl 2-hydroxybutanoate, 4-n-cbz-2-hydroxymethylpiperazine, (-)-tert-Butyl (S)-2-hydroxybutyrate
| Molecular Formula | C8H16O3 |
|---|---|
| Molecular Weight | 160.11 g/mol |
| LogP | 1.099 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.10994 |
| Heavy Atoms | 11 |
| Complexity | 134.76282 |
Chemical Identifiers
| CAS Number | 110171-06-7 |
|---|---|
| SMILES | CCC(C(=O)OC(C)(C)C)O |
Product Overview
Tert-butyl 2-hydroxybutanoate (CAS 110171-06-7), with molecular formula C8H16O3 and molecular weight 160.11 g/mol. IUPAC: tert-butyl 2-hydroxybutanoate.
Chemical Property Profile of Tert-butyl 2-hydroxybutanoate
Property Insights of Tert-butyl 2-hydroxybutanoate
The XLogP value of 1.099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 2-hydroxybutanoate. With a topological polar surface area (TPSA) of 46.53 Ų, Tert-butyl 2-hydroxybutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl 2-hydroxybutanoate has 1 hydrogen bond donor(s) and 3 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 Tert-butyl 2-hydroxybutanoate?
The CAS number of Tert-butyl 2-hydroxybutanoate is 110171-06-7.
What is the molecular formula of Tert-butyl 2-hydroxybutanoate?
The molecular formula of Tert-butyl 2-hydroxybutanoate is C8H16O3.
What is the molecular weight of Tert-butyl 2-hydroxybutanoate?
The molecular weight of Tert-butyl 2-hydroxybutanoate is 160.11 g/mol.
Where can I buy Tert-butyl 2-hydroxybutanoate?
You can request a quote for Tert-butyl 2-hydroxybutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl 2-hydroxybutanoate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 2-hydroxybutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.