6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran
TL;DR: 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran (CAS 887571-79-1) is a chemical compound with molecular formula C13H16Cl2O and molecular weight 258.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dichloro-2,2-dimethyl-5-propan-2-yl-3H-1-benzofuran
Also Known As: 6,7-dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran, AP-836/41220467, 6,7-dichloro-2,2-dimethyl-5-propan-2-yl-3H-1-benzofuran, 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydrobenzofuran, 6,7-dichloro-2,2-dimethyl-5-(methylethyl)-2,3-dihydrobenzo[b]furan
| Molecular Formula | C13H16Cl2O |
|---|---|
| Molecular Weight | 258.06 g/mol |
| LogP | 4.8303 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.05783 |
| Heavy Atoms | 16 |
| Complexity | 436.049 |
Chemical Identifiers
| CAS Number | 887571-79-1 |
|---|---|
| SMILES | CC(C)C1=C(C(=C2C(=C1)CC(O2)(C)C)Cl)Cl |
Product Overview
6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran (CAS 887571-79-1), with molecular formula C13H16Cl2O and molecular weight 258.06 g/mol. IUPAC: 6,7-dichloro-2,2-dimethyl-5-propan-2-yl-3H-1-benzofuran.
Chemical Property Profile of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran
Property Insights of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran
The XLogP value of 4.8303 indicates that 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran 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 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran?
The CAS number of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran is 887571-79-1.
What is the molecular formula of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran?
The molecular formula of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran is C13H16Cl2O.
What is the molecular weight of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran?
The molecular weight of 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran is 258.06 g/mol.
Where can I buy 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran?
You can request a quote for 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dichloro-5-isopropyl-2,2-dimethyl-2,3-dihydro-1-benzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.