3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one
TL;DR: 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one (CAS 57697-62-8) is a chemical compound with molecular formula C18H14Br2O2 and molecular weight 419.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dibromo-5,5-bis(4-methylphenyl)furan-2-one
Also Known As: 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one, 3,4-dibromo-5,5-bis(4-methylphenyl)furan-2-one, 3,4-dibromo-5,5-bis(4-methylphenyl)-2(5H)-furanone
| Molecular Formula | C18H14Br2O2 |
|---|---|
| Molecular Weight | 419.94 g/mol |
| LogP | 5.10524 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 419.93604 |
| Heavy Atoms | 22 |
| Complexity | 713.1791 |
Chemical Identifiers
| CAS Number | 57697-62-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(C(=C(C(=O)O2)Br)Br)C3=CC=C(C=C3)C |
Product Overview
3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one (CAS 57697-62-8), with molecular formula C18H14Br2O2 and molecular weight 419.94 g/mol. IUPAC: 3,4-dibromo-5,5-bis(4-methylphenyl)furan-2-one.
Chemical Property Profile of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one
Property Insights of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one
The XLogP value of 5.10524 indicates that 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one?
The CAS number of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one is 57697-62-8.
What is the molecular formula of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one?
The molecular formula of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one is C18H14Br2O2.
What is the molecular weight of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one?
The molecular weight of 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one is 419.94 g/mol.
Where can I buy 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one?
You can request a quote for 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dibromo-5,5-di-p-tolylfuran-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.