2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-
TL;DR: 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- (CAS 155272-56-3) is a chemical compound with molecular formula C12H11BrO3 and molecular weight 281.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-bromoethoxy)-4-methylchromen-2-one
Also Known As: 7-(2-bromoethoxy)-4-methyl-2H-chromen-2-one, Benzofuran-7-carbaldehyde, 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-, 7-(2-bromoethoxy)-4-methylchromen-2-one, Coumarin, 7-(2-bromoethoxy)-4-methyl-
| Molecular Formula | C12H11BrO3 |
|---|---|
| Molecular Weight | 281.99 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.98917 |
| Heavy Atoms | 16 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 155272-56-3 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OCCBr |
| InChIKey | XLLJFWFFIDCGMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- (CAS 155272-56-3), with molecular formula C12H11BrO3 and molecular weight 281.99 g/mol. IUPAC: 7-(2-bromoethoxy)-4-methylchromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-
Property Insights of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-
The XLogP value of 3.0 indicates that 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- 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 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-?
The CAS number of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- is 155272-56-3.
What is the molecular formula of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-?
The molecular formula of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- is C12H11BrO3.
What is the molecular weight of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-?
The molecular weight of 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- is 281.99 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-?
You can request a quote for 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 7-(2-bromoethoxy)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.