2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate
TL;DR: 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate (CAS 21620-95-1) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-3H-1-benzofuran-7-yl) acetate
Also Known As: 2,2-dimethyl-2,3-dihydrobenzofuran-7-yl acetate, (2,2-dimethyl-3H-1-benzofuran-7-yl) acetate, 7-acetoxy-2,3-dihydro-2,2-dimethylbenzofuran, 7-acetoxy-2,3-dihydro-2,2-dimethyl-benzofuran
| Molecular Formula | C12H14O3 |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 2.3254 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.0943 |
| Heavy Atoms | 15 |
| Complexity | 407.3283 |
Chemical Identifiers
| CAS Number | 21620-95-1 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC2=C1OC(C2)(C)C |
Product Overview
2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate (CAS 21620-95-1), with molecular formula C12H14O3 and molecular weight 206.09 g/mol. IUPAC: (2,2-dimethyl-3H-1-benzofuran-7-yl) acetate.
Chemical Property Profile of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate
Property Insights of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate
The XLogP value of 2.3254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate. With a topological polar surface area (TPSA) of 35.53 Ų, 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate has 0 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 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate?
The CAS number of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate is 21620-95-1.
What is the molecular formula of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate?
The molecular formula of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate is C12H14O3.
What is the molecular weight of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate?
The molecular weight of 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate is 206.09 g/mol.
Where can I buy 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate?
You can request a quote for 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-2,3-dihydrobenzofuran-7-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.