2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol
TL;DR: 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol (CAS 81199-24-8) is a chemical compound with molecular formula C16H27NO and molecular weight 249.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-6-[(dimethylamino)methyl]-4-propan-2-ylphenol
Also Known As: NCIStruc1_000528, NCIStruc2_000611, 2-tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol, NCI60_001796, 2-tert-butyl-6-(dimethylaminomethyl)-4-propan-2-ylphenol
| Molecular Formula | C16H27NO |
|---|---|
| Molecular Weight | 249.21 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.20926 |
| Heavy Atoms | 18 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 81199-24-8 |
|---|---|
| SMILES | CC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CN(C)C |
| InChIKey | GVUNWVGYJROCEX-UHFFFAOYSA-N |
Product Overview
2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol (CAS 81199-24-8), with molecular formula C16H27NO and molecular weight 249.21 g/mol. IUPAC: 2-tert-butyl-6-[(dimethylamino)methyl]-4-propan-2-ylphenol.
Chemical Property Profile of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol
Property Insights of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol
The XLogP value of 4.2 indicates that 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol has 1 hydrogen bond donor(s) and 2 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 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol?
The CAS number of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol is 81199-24-8.
What is the molecular formula of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol?
The molecular formula of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol is C16H27NO.
What is the molecular weight of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol?
The molecular weight of 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol is 249.21 g/mol.
Where can I buy 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol?
You can request a quote for 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Tert-butyl-6-((dimethylamino)methyl)-4-isopropylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.