(2S)-2-(1,1-Dimethylethyl)oxirane
TL;DR: (2S)-2-(1,1-Dimethylethyl)oxirane (CAS 40102-55-4) is a chemical compound with molecular formula C6H12O and molecular weight 100.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-tert-butyloxirane
Also Known As: (2S)-2-tert-butyloxirane, tert-Butyloxirane, (s)-t-butyloxirane, (S)-2-tert-Butyloxirane, (S)-2-(tert-Butyl)oxirane
| Molecular Formula | C6H12O |
|---|---|
| Molecular Weight | 100.09 g/mol |
| LogP | 1.4313 |
| Topological Polar Surface Area | 12.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.08881 |
| Heavy Atoms | 7 |
| Complexity | 66.73943 |
Chemical Identifiers
| CAS Number | 40102-55-4 |
|---|---|
| SMILES | CC(C)(C)[C@H]1CO1 |
Product Overview
(2S)-2-(1,1-Dimethylethyl)oxirane (CAS 40102-55-4), with molecular formula C6H12O and molecular weight 100.09 g/mol. IUPAC: (2S)-2-tert-butyloxirane.
Chemical Property Profile of (2S)-2-(1,1-Dimethylethyl)oxirane
Property Insights of (2S)-2-(1,1-Dimethylethyl)oxirane
The XLogP value of 1.4313 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(1,1-Dimethylethyl)oxirane. With a topological polar surface area (TPSA) of 12.53 Ų, (2S)-2-(1,1-Dimethylethyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-2-(1,1-Dimethylethyl)oxirane has 0 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)-2-(1,1-Dimethylethyl)oxirane?
The CAS number of (2S)-2-(1,1-Dimethylethyl)oxirane is 40102-55-4.
What is the molecular formula of (2S)-2-(1,1-Dimethylethyl)oxirane?
The molecular formula of (2S)-2-(1,1-Dimethylethyl)oxirane is C6H12O.
What is the molecular weight of (2S)-2-(1,1-Dimethylethyl)oxirane?
The molecular weight of (2S)-2-(1,1-Dimethylethyl)oxirane is 100.09 g/mol.
Where can I buy (2S)-2-(1,1-Dimethylethyl)oxirane?
You can request a quote for (2S)-2-(1,1-Dimethylethyl)oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(1,1-Dimethylethyl)oxirane?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(1,1-Dimethylethyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.