1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-
TL;DR: 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- (CAS 87402-66-2) is a chemical compound with molecular formula C14H12Br2O4 and molecular weight 401.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-[(3-bromo-4-hydroxyphenyl)methyl]-4-(hydroxymethyl)benzene-1,2-diol
Also Known As: AVRAINVILLEOL, 9-Amino-6-trifluoromethylbenzonorbornene, 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-, 6-bromo-3-[(3-bromo-4-hydroxyphenyl)methyl]-4-(hydroxymethyl)benzene-1,2-diol, 2-(3-Bromo-4-hydroxybenzyl)-5-bromo-3,4-dihydroxybenzenemethanol
| Molecular Formula | C14H12Br2O4 |
|---|---|
| Molecular Weight | 401.91 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.91022 |
| Heavy Atoms | 20 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 87402-66-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1CC2=C(C(=C(C=C2CO)Br)O)O)Br)O |
| InChIKey | JAJYCHVUMIGCEE-UHFFFAOYSA-N |
Product Overview
1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- (CAS 87402-66-2), with molecular formula C14H12Br2O4 and molecular weight 401.91 g/mol. IUPAC: 6-bromo-3-[(3-bromo-4-hydroxyphenyl)methyl]-4-(hydroxymethyl)benzene-1,2-diol.
Chemical Property Profile of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-
Property Insights of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-
The XLogP value of 3.3 indicates that 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-. Following Lipinski's Rule of Five, 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- has 4 hydrogen bond donor(s) and 4 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 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-?
The CAS number of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- is 87402-66-2.
What is the molecular formula of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-?
The molecular formula of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- is C14H12Br2O4.
What is the molecular weight of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-?
The molecular weight of 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- is 401.91 g/mol.
Where can I buy 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-?
You can request a quote for 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenediol, 6-bromo-3-((3-bromo-4-hydroxyphenyl)methyl)-4-(hydroxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.