Benzofuran, 3-(1,1-dimethylethyl)-
TL;DR: Benzofuran, 3-(1,1-dimethylethyl)- (CAS 25252-19-1) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-1-benzofuran
Also Known As: 3-tert-butyl-1-benzofuran, 3-t-butylbenzofuran, 3-tert-butylbenzofuran, 3-(tert-Butyl)benzofuran, 3-tert-butyl-benzofuran
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 3.7303 |
| Topological Polar Surface Area | 13.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 417.86224 |
Chemical Identifiers
| CAS Number | 25252-19-1 |
|---|---|
| SMILES | CC(C)(C)C1=COC2=CC=CC=C21 |
Product Overview
Benzofuran, 3-(1,1-dimethylethyl)- (CAS 25252-19-1), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 3-tert-butyl-1-benzofuran.
Chemical Property Profile of Benzofuran, 3-(1,1-dimethylethyl)-
Property Insights of Benzofuran, 3-(1,1-dimethylethyl)-
The XLogP value of 3.7303 indicates that Benzofuran, 3-(1,1-dimethylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.14 Ų, Benzofuran, 3-(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzofuran, 3-(1,1-dimethylethyl)- 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 Benzofuran, 3-(1,1-dimethylethyl)-?
The CAS number of Benzofuran, 3-(1,1-dimethylethyl)- is 25252-19-1.
What is the molecular formula of Benzofuran, 3-(1,1-dimethylethyl)-?
The molecular formula of Benzofuran, 3-(1,1-dimethylethyl)- is C12H14O.
What is the molecular weight of Benzofuran, 3-(1,1-dimethylethyl)-?
The molecular weight of Benzofuran, 3-(1,1-dimethylethyl)- is 174.10 g/mol.
Where can I buy Benzofuran, 3-(1,1-dimethylethyl)-?
You can request a quote for Benzofuran, 3-(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofuran, 3-(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzofuran, 3-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.