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Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate
TL;DR: Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate (CAS 633282-68-5) is a chemical compound with molecular formula C13H16O4 and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetate
Also Known As: ChemDiv2_002736, methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate, methyl 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetate, Methyl 2-((2,2-dimethyl-2,3-dihydrobenzofuran-7-yl)oxy)acetate, methyl 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate
| Molecular Formula | C13H16O4 |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 1.9519 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.10486 |
| Heavy Atoms | 17 |
| Complexity | 437.04565 |
Chemical Identifiers
| CAS Number | 633282-68-5 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OCC(=O)OC)C |
Product Overview
Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate (CAS 633282-68-5), with molecular formula C13H16O4 and molecular weight 236.10 g/mol. IUPAC: methyl 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetate.
Chemical Property Profile of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate
Property Insights of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate
The XLogP value of 1.9519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate. With a topological polar surface area (TPSA) of 44.76 Ų, Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate has 0 hydrogen bond donor(s) and 4 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 Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate?
The CAS number of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate is 633282-68-5.
What is the molecular formula of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate?
The molecular formula of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate is C13H16O4.
What is the molecular weight of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate?
The molecular weight of Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate is 236.10 g/mol.
Where can I buy Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate?
You can request a quote for Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.