4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-
TL;DR: 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- (CAS 88952-79-8) is a chemical compound with molecular formula C16H11BrO2 and molecular weight 313.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-(2-methylphenyl)chromen-4-one
Also Known As: 6-Bromo-2'-methylflavone, 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-, 6-bromo-2-(2-methylphenyl)chromen-4-one, 6-Bromo-2-(o-tolyl)-4H-chromen-4-one, 6-bromo-2-(2-methylphenyl)-4H-chromen-4-one
| Molecular Formula | C16H11BrO2 |
|---|---|
| Molecular Weight | 313.99 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.99423 |
| Heavy Atoms | 19 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 88952-79-8 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=CC(=O)C3=C(O2)C=CC(=C3)Br |
| InChIKey | OPNDGMXTQUWZJW-UHFFFAOYSA-N |
Product Overview
4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- (CAS 88952-79-8), with molecular formula C16H11BrO2 and molecular weight 313.99 g/mol. IUPAC: 6-bromo-2-(2-methylphenyl)chromen-4-one.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-
Property Insights of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-
The XLogP value of 5.0 indicates that 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- has 0 hydrogen bond donor(s) and 2 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 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-?
The CAS number of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- is 88952-79-8.
What is the molecular formula of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-?
The molecular formula of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- is C16H11BrO2.
What is the molecular weight of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-?
The molecular weight of 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- is 313.99 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-?
You can request a quote for 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 6-bromo-2-(2-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.