Benzofuran, 6-chloro-2,3-dimethyl-
TL;DR: Benzofuran, 6-chloro-2,3-dimethyl- (CAS 27044-66-2) is a chemical compound with molecular formula C10H9ClO and molecular weight 180.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2,3-dimethyl-1-benzofuran
Also Known As: Benzofuran, 6-chloro-2,3-dimethyl-, 6-chloro-2,3-dimethylBenzofuran, 6-chloro-2,3-dimethyl-1-benzofuran, 6-chloro-2,3-dimethyl-benzofuran, RefChem:326469
| Molecular Formula | C10H9ClO |
|---|---|
| Molecular Weight | 180.03 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.0342 |
| Heavy Atoms | 12 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 27044-66-2 |
|---|---|
| SMILES | CC1=C(OC2=C1C=CC(=C2)Cl)C |
| InChIKey | OVZZAHVQZBSYCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzofuran, 6-chloro-2,3-dimethyl- (CAS 27044-66-2), with molecular formula C10H9ClO and molecular weight 180.03 g/mol. IUPAC: 6-chloro-2,3-dimethyl-1-benzofuran.
Chemical Property Profile of Benzofuran, 6-chloro-2,3-dimethyl-
Property Insights of Benzofuran, 6-chloro-2,3-dimethyl-
The XLogP value of 3.7 indicates that Benzofuran, 6-chloro-2,3-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, Benzofuran, 6-chloro-2,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzofuran, 6-chloro-2,3-dimethyl- 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, 6-chloro-2,3-dimethyl-?
The CAS number of Benzofuran, 6-chloro-2,3-dimethyl- is 27044-66-2.
What is the molecular formula of Benzofuran, 6-chloro-2,3-dimethyl-?
The molecular formula of Benzofuran, 6-chloro-2,3-dimethyl- is C10H9ClO.
What is the molecular weight of Benzofuran, 6-chloro-2,3-dimethyl-?
The molecular weight of Benzofuran, 6-chloro-2,3-dimethyl- is 180.03 g/mol.
Where can I buy Benzofuran, 6-chloro-2,3-dimethyl-?
You can request a quote for Benzofuran, 6-chloro-2,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofuran, 6-chloro-2,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzofuran, 6-chloro-2,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.