3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one
TL;DR: 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one (CAS 98048-84-1) is a chemical compound with molecular formula C8H15NO3 and molecular weight 173.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-5-(hydroxymethyl)-1,3-oxazolidin-2-one
Also Known As: Maybridge3_000807, 3- -5- oxazolidin-2-one, EINECS 288-150-5, 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one, 3-tert-butyl-5-(hydroxymethyl)-1,3-oxazolidin-2-one
| Molecular Formula | C8H15NO3 |
|---|---|
| Molecular Weight | 173.11 g/mol |
| LogP | 0.598 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.1052 |
| Heavy Atoms | 12 |
| Complexity | 185.23222 |
Chemical Identifiers
| CAS Number | 98048-84-1 |
|---|---|
| SMILES | CC(C)(C)N1CC(OC1=O)CO |
Product Overview
3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one (CAS 98048-84-1), with molecular formula C8H15NO3 and molecular weight 173.11 g/mol. IUPAC: 3-tert-butyl-5-(hydroxymethyl)-1,3-oxazolidin-2-one.
Chemical Property Profile of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one
Property Insights of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one
The XLogP value of 0.598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one. With a topological polar surface area (TPSA) of 49.77 Ų, 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one 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 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one?
The CAS number of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one is 98048-84-1.
What is the molecular formula of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one?
The molecular formula of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one is C8H15NO3.
What is the molecular weight of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one?
The molecular weight of 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one is 173.11 g/mol.
Where can I buy 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one?
You can request a quote for 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,1-Dimethylethyl)-5-(hydroxymethyl)oxazolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.