5-tert-Butyl-o-anisidine
TL;DR: 5-tert-Butyl-o-anisidine (CAS 3535-88-4) is a chemical compound with molecular formula C11H17NO and molecular weight 179.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-2-methoxyaniline
Also Known As: 5-tert-Butyl-2-methoxyaniline, 5-(tert-butyl)-2-methoxyaniline, 5-tert-Butyl-o-anisidine, 2-Amine-4-tert-butylanisole, 4-tert-Butyl-o-anisidine
| Molecular Formula | C11H17NO |
|---|---|
| Molecular Weight | 179.13 g/mol |
| LogP | 2.5749 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.13101 |
| Heavy Atoms | 13 |
| Complexity | 299.44885 |
Chemical Identifiers
| CAS Number | 3535-88-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)OC)N |
Product Overview
5-tert-Butyl-o-anisidine (CAS 3535-88-4), with molecular formula C11H17NO and molecular weight 179.13 g/mol. IUPAC: 5-tert-butyl-2-methoxyaniline.
Chemical Property Profile of 5-tert-Butyl-o-anisidine
Property Insights of 5-tert-Butyl-o-anisidine
The XLogP value of 2.5749 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-tert-Butyl-o-anisidine. With a topological polar surface area (TPSA) of 35.25 Ų, 5-tert-Butyl-o-anisidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-tert-Butyl-o-anisidine 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 5-tert-Butyl-o-anisidine?
The CAS number of 5-tert-Butyl-o-anisidine is 3535-88-4.
What is the molecular formula of 5-tert-Butyl-o-anisidine?
The molecular formula of 5-tert-Butyl-o-anisidine is C11H17NO.
What is the molecular weight of 5-tert-Butyl-o-anisidine?
The molecular weight of 5-tert-Butyl-o-anisidine is 179.13 g/mol.
Where can I buy 5-tert-Butyl-o-anisidine?
You can request a quote for 5-tert-Butyl-o-anisidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-tert-Butyl-o-anisidine?
Yes, KEHONG BIO provides custom synthesis services for 5-tert-Butyl-o-anisidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.