7-tert-Butyl-2(3H)-benzofuranone
TL;DR: 7-tert-Butyl-2(3H)-benzofuranone (CAS 124435-70-7) is a chemical compound with molecular formula C12H14O2 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-tert-butyl-3H-1-benzofuran-2-one
Also Known As: 7-tert-butyl-3H-benzofuran-2-one, 7-tert-Butyl-2(3H)-benzofuranone, 7-tert-Butyl-2(3H) -benzofuranone, 7-(tert-Butyl)benzofuran-2(3H)-one, 7-(1,1-dimethylethyl)-2(3H)-benzofuranone
| Molecular Formula | C12H14O2 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 2.4456 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.09938 |
| Heavy Atoms | 14 |
| Complexity | 385.79846 |
Chemical Identifiers
| CAS Number | 124435-70-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=CC2=C1OC(=O)C2 |
Product Overview
7-tert-Butyl-2(3H)-benzofuranone (CAS 124435-70-7), with molecular formula C12H14O2 and molecular weight 190.10 g/mol. IUPAC: 7-tert-butyl-3H-1-benzofuran-2-one.
Chemical Property Profile of 7-tert-Butyl-2(3H)-benzofuranone
Property Insights of 7-tert-Butyl-2(3H)-benzofuranone
The XLogP value of 2.4456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-tert-Butyl-2(3H)-benzofuranone. With a topological polar surface area (TPSA) of 26.3 Ų, 7-tert-Butyl-2(3H)-benzofuranone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-tert-Butyl-2(3H)-benzofuranone 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 7-tert-Butyl-2(3H)-benzofuranone?
The CAS number of 7-tert-Butyl-2(3H)-benzofuranone is 124435-70-7.
What is the molecular formula of 7-tert-Butyl-2(3H)-benzofuranone?
The molecular formula of 7-tert-Butyl-2(3H)-benzofuranone is C12H14O2.
What is the molecular weight of 7-tert-Butyl-2(3H)-benzofuranone?
The molecular weight of 7-tert-Butyl-2(3H)-benzofuranone is 190.10 g/mol.
Where can I buy 7-tert-Butyl-2(3H)-benzofuranone?
You can request a quote for 7-tert-Butyl-2(3H)-benzofuranone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-tert-Butyl-2(3H)-benzofuranone?
Yes, KEHONG BIO provides custom synthesis services for 7-tert-Butyl-2(3H)-benzofuranone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.