1-tert-Butyl-2-(2,3-epoxypropoxy)benzene
TL;DR: 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene (CAS 26447-45-0) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-tert-butylphenoxy)methyl]oxirane
Also Known As: 2-[(2-tert-butylphenoxy)methyl]oxirane, o-t-Butylphenylacetat, 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene, t-Butyl phenyl glycidyl ether, NIOSH/KN5400000
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 2.7617 |
| Topological Polar Surface Area | 21.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 334.63434 |
Chemical Identifiers
| CAS Number | 26447-45-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=CC=C1OCC2CO2 |
Product Overview
1-tert-Butyl-2-(2,3-epoxypropoxy)benzene (CAS 26447-45-0), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 2-[(2-tert-butylphenoxy)methyl]oxirane.
Chemical Property Profile of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene
Property Insights of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene
The XLogP value of 2.7617 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene. With a topological polar surface area (TPSA) of 21.76 Ų, 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene has 0 hydrogen bond donor(s) and 2 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 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene?
The CAS number of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene is 26447-45-0.
What is the molecular formula of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene?
The molecular formula of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene is C13H18O2.
What is the molecular weight of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene?
The molecular weight of 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene is 206.13 g/mol.
Where can I buy 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene?
You can request a quote for 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-tert-Butyl-2-(2,3-epoxypropoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.