1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone
TL;DR: 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone (CAS 63411-84-7) is a chemical compound with molecular formula C8H6Br2O3 and molecular weight 307.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dibromo-2,6-dihydroxyphenyl)ethanone
Also Known As: ghl.PD_Mitscher_leg0.1170, 1-(3,5-dibromo-2,6-dihydroxyphenyl)ethanone, 1-(3,5-dibromo-2,6-dihydroxy-phenyl)-ethanone, doi:10.14272/GHPWLLSLLWHDPT-UHFFFAOYSA-N.1
| Molecular Formula | C8H6Br2O3 |
|---|---|
| Molecular Weight | 307.87 g/mol |
| LogP | 2.8254 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.86838 |
| Heavy Atoms | 13 |
| Complexity | 347.89215 |
Chemical Identifiers
| CAS Number | 63411-84-7 |
|---|---|
| SMILES | CC(=O)C1=C(C(=CC(=C1O)Br)Br)O |
Product Overview
1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone (CAS 63411-84-7), with molecular formula C8H6Br2O3 and molecular weight 307.87 g/mol. IUPAC: 1-(3,5-dibromo-2,6-dihydroxyphenyl)ethanone.
Chemical Property Profile of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone
Property Insights of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone
The XLogP value of 2.8254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone. With a topological polar surface area (TPSA) of 57.53 Ų, 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone has 2 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 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone?
The CAS number of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone is 63411-84-7.
What is the molecular formula of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone?
The molecular formula of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone is C8H6Br2O3.
What is the molecular weight of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone?
The molecular weight of 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone is 307.87 g/mol.
Where can I buy 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone?
You can request a quote for 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Dibromo-2,6-dihydroxyphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.