2-(4-(Propan-2-yl)phenyl)ethan-1-amine
TL;DR: 2-(4-(Propan-2-yl)phenyl)ethan-1-amine (CAS 84558-03-2) is a chemical compound with molecular formula C11H17N and molecular weight 163.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-propan-2-ylphenyl)ethanamine
Also Known As: 2-(4-isopropylphenyl)ethanamine, 2-(4-propan-2-ylphenyl)ethanamine, 4-isopropylphenethylamine, 2-(4-Isopropyl-phenyl)-ethylamine, 4-Isopropyl-phenaethylamin
| Molecular Formula | C11H17N |
|---|---|
| Molecular Weight | 163.14 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.1361 |
| Heavy Atoms | 12 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 84558-03-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CCN |
| InChIKey | ZBLQKSNIFYXZTI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-(Propan-2-yl)phenyl)ethan-1-amine (CAS 84558-03-2), with molecular formula C11H17N and molecular weight 163.14 g/mol. IUPAC: 2-(4-propan-2-ylphenyl)ethanamine.
Chemical Property Profile of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine
Property Insights of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-(Propan-2-yl)phenyl)ethan-1-amine. With a topological polar surface area (TPSA) of 26.0 Ų, 2-(4-(Propan-2-yl)phenyl)ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-(Propan-2-yl)phenyl)ethan-1-amine 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 2-(4-(Propan-2-yl)phenyl)ethan-1-amine?
The CAS number of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine is 84558-03-2.
What is the molecular formula of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine?
The molecular formula of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine is C11H17N.
What is the molecular weight of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine?
The molecular weight of 2-(4-(Propan-2-yl)phenyl)ethan-1-amine is 163.14 g/mol.
Where can I buy 2-(4-(Propan-2-yl)phenyl)ethan-1-amine?
You can request a quote for 2-(4-(Propan-2-yl)phenyl)ethan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(Propan-2-yl)phenyl)ethan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(Propan-2-yl)phenyl)ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.