3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol
TL;DR: 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol (CAS 4950-06-5) is a chemical compound with molecular formula C7H6Br2O3 and molecular weight 295.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dibromo-5-(hydroxymethyl)benzene-1,2-diol
Also Known As: Lanosol, Lanasol, LANESOL, 3,4-dibromo-5-(hydroxymethyl)benzene-1,2-diol, 2,3-dibromo-4,5-dihydroxybenzyl alcohol
| Molecular Formula | C7H6Br2O3 |
|---|---|
| Molecular Weight | 295.87 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.86633 |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 4950-06-5 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1O)O)Br)Br)CO |
| InChIKey | GKZCMEUEEFOXIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol (CAS 4950-06-5), with molecular formula C7H6Br2O3 and molecular weight 295.87 g/mol. IUPAC: 3,4-dibromo-5-(hydroxymethyl)benzene-1,2-diol.
Chemical Property Profile of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol
Property Insights of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol. Following Lipinski's Rule of Five, 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol has 3 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 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol?
The CAS number of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol is 4950-06-5.
What is the molecular formula of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol?
The molecular formula of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol is C7H6Br2O3.
What is the molecular weight of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol?
The molecular weight of 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol is 295.87 g/mol.
Where can I buy 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol?
You can request a quote for 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol 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-(hydroxymethyl)-1,2-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dibromo-5-(hydroxymethyl)-1,2-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.