4-(2-Methylpropoxy)aniline
TL;DR: 4-(2-Methylpropoxy)aniline (CAS 5198-04-9) is a chemical compound with molecular formula C10H15NO and molecular weight 165.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methylpropoxy)aniline
Also Known As: 4-Isobutoxyaniline, 4-Isobutoxy-phenylamine, (4-isobutoxyphenyl)amine, 4-(2-methylpropoxy)aniline, Solvent Yellow 4
| Molecular Formula | C10H15NO |
|---|---|
| Molecular Weight | 165.12 g/mol |
| LogP | 2.3036 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 165.11537 |
| Heavy Atoms | 12 |
| Complexity | 228.09883 |
Chemical Identifiers
| CAS Number | 5198-04-9 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)N |
Product Overview
4-(2-Methylpropoxy)aniline (CAS 5198-04-9), with molecular formula C10H15NO and molecular weight 165.12 g/mol. IUPAC: 4-(2-methylpropoxy)aniline.
Chemical Property Profile of 4-(2-Methylpropoxy)aniline
Property Insights of 4-(2-Methylpropoxy)aniline
The XLogP value of 2.3036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Methylpropoxy)aniline. With a topological polar surface area (TPSA) of 35.25 Ų, 4-(2-Methylpropoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Methylpropoxy)aniline 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 4-(2-Methylpropoxy)aniline?
The CAS number of 4-(2-Methylpropoxy)aniline is 5198-04-9.
What is the molecular formula of 4-(2-Methylpropoxy)aniline?
The molecular formula of 4-(2-Methylpropoxy)aniline is C10H15NO.
What is the molecular weight of 4-(2-Methylpropoxy)aniline?
The molecular weight of 4-(2-Methylpropoxy)aniline is 165.12 g/mol.
Where can I buy 4-(2-Methylpropoxy)aniline?
You can request a quote for 4-(2-Methylpropoxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Methylpropoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Methylpropoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.