Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-
TL;DR: Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- (CAS 6946-59-4) is a chemical compound with molecular formula C13H20BrNO2 and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-4-tert-butyl-6-[(2-hydroxyethylamino)methyl]phenol
Also Known As: 2-bromo-6-[ methyl]-4-tert-butyl-phenol, Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-, 2-bromo-4-tert-butyl-6-[(2-hydroxyethylamino)methyl]phenol, 2-BROMO-6-[(2-HYDROXYETHYLAMINO)METHYL]-4-TERT-BUTYL-PHENOL, 2-Bromo-4-tert-butyl-6-{[(2-hydroxyethyl)amino]methyl}phenol
| Molecular Formula | C13H20BrNO2 |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.06775 |
| Heavy Atoms | 17 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 6946-59-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)Br)O)CNCCO |
| InChIKey | WVZUMIUCLQYMSB-UHFFFAOYSA-N |
Product Overview
Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- (CAS 6946-59-4), with molecular formula C13H20BrNO2 and molecular weight 301.07 g/mol. IUPAC: 2-bromo-4-tert-butyl-6-[(2-hydroxyethylamino)methyl]phenol.
Chemical Property Profile of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-
Property Insights of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-
The XLogP value of 3.2 indicates that Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.5 Ų, Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- 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 Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-?
The CAS number of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- is 6946-59-4.
What is the molecular formula of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-?
The molecular formula of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- is C13H20BrNO2.
What is the molecular weight of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-?
The molecular weight of Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- is 301.07 g/mol.
Where can I buy Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-?
You can request a quote for Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2-(3-bromo-5-tert-butyl-2-hydroxybenzyl-amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.