Phenol, 2,3,4,6-tetrabromo-5-methyl-
TL;DR: Phenol, 2,3,4,6-tetrabromo-5-methyl- (CAS 58169-99-6) is a chemical compound with molecular formula C7H4Br4O and molecular weight 419.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,6-tetrabromo-5-methylphenol
Also Known As: Tetrabromo-m-cresol, 2,3,4,6-tetrabromo-5-methylphenol, Tetrabrom-m-kresol, 2,3,4,6-Tetrabromo-m-cresol, Phenol, 2,3,4,6-tetrabromo-5-methyl-
| Molecular Formula | C7H4Br4O |
|---|---|
| Molecular Weight | 419.70 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 423.69547 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 58169-99-6 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1Br)Br)Br)O)Br |
| InChIKey | UNPZKTDWJIQJJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2,3,4,6-tetrabromo-5-methyl- (CAS 58169-99-6), with molecular formula C7H4Br4O and molecular weight 419.70 g/mol. IUPAC: 2,3,4,6-tetrabromo-5-methylphenol.
Chemical Property Profile of Phenol, 2,3,4,6-tetrabromo-5-methyl-
Property Insights of Phenol, 2,3,4,6-tetrabromo-5-methyl-
The XLogP value of 4.7 indicates that Phenol, 2,3,4,6-tetrabromo-5-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, 2,3,4,6-tetrabromo-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,3,4,6-tetrabromo-5-methyl- has 1 hydrogen bond donor(s) and 1 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 Phenol, 2,3,4,6-tetrabromo-5-methyl-?
The CAS number of Phenol, 2,3,4,6-tetrabromo-5-methyl- is 58169-99-6.
What is the molecular formula of Phenol, 2,3,4,6-tetrabromo-5-methyl-?
The molecular formula of Phenol, 2,3,4,6-tetrabromo-5-methyl- is C7H4Br4O.
What is the molecular weight of Phenol, 2,3,4,6-tetrabromo-5-methyl-?
The molecular weight of Phenol, 2,3,4,6-tetrabromo-5-methyl- is 419.70 g/mol.
Where can I buy Phenol, 2,3,4,6-tetrabromo-5-methyl-?
You can request a quote for Phenol, 2,3,4,6-tetrabromo-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,3,4,6-tetrabromo-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,3,4,6-tetrabromo-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.