2-(4-Aminophenyl)-2-oxazoline
TL;DR: 2-(4-Aminophenyl)-2-oxazoline (CAS 54472-46-7) is a chemical compound with molecular formula C9H10N2O and molecular weight 162.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4,5-dihydro-1,3-oxazol-2-yl)aniline
Also Known As: 4-(4,5-dihydro-1,3-oxazol-2-yl)aniline, 4-aminophenyl oxazoline, 2-(4-aminophenyl)-2-oxazoline, 2-(p-Aminophenyl)oxazoline, 2-(4-Aminophenyl)oxazoline
| Molecular Formula | C9H10N2O |
|---|---|
| Molecular Weight | 162.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.07932 |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 54472-46-7 |
|---|---|
| SMILES | C1COC(=N1)C2=CC=C(C=C2)N |
| InChIKey | JUTGVXOSFVZIQA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Aminophenyl)-2-oxazoline (CAS 54472-46-7), with molecular formula C9H10N2O and molecular weight 162.08 g/mol. IUPAC: 4-(4,5-dihydro-1,3-oxazol-2-yl)aniline.
Chemical Property Profile of 2-(4-Aminophenyl)-2-oxazoline
Property Insights of 2-(4-Aminophenyl)-2-oxazoline
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Aminophenyl)-2-oxazoline. With a topological polar surface area (TPSA) of 47.6 Ų, 2-(4-Aminophenyl)-2-oxazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Aminophenyl)-2-oxazoline has 1 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 2-(4-Aminophenyl)-2-oxazoline?
The CAS number of 2-(4-Aminophenyl)-2-oxazoline is 54472-46-7.
What is the molecular formula of 2-(4-Aminophenyl)-2-oxazoline?
The molecular formula of 2-(4-Aminophenyl)-2-oxazoline is C9H10N2O.
What is the molecular weight of 2-(4-Aminophenyl)-2-oxazoline?
The molecular weight of 2-(4-Aminophenyl)-2-oxazoline is 162.08 g/mol.
Where can I buy 2-(4-Aminophenyl)-2-oxazoline?
You can request a quote for 2-(4-Aminophenyl)-2-oxazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Aminophenyl)-2-oxazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Aminophenyl)-2-oxazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.