2-(2H-Indazol-2-yl)aniline
TL;DR: 2-(2H-Indazol-2-yl)aniline (CAS 54012-98-5) is a chemical compound with molecular formula C13H11N3 and molecular weight 209.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-indazol-2-ylaniline
Also Known As: 2-(2H-Indazol-2-yl)aniline, 2-indazol-2-ylaniline, 2-Indazol-2-ylphenylamine, 2-(2h-indazol-2-yl)-aniline, 2-(o-Aminophenyl)-2H-indazol
| Molecular Formula | C13H11N3 |
|---|---|
| Molecular Weight | 209.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.09529 |
| Heavy Atoms | 16 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 54012-98-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)N2C=C3C=CC=CC3=N2 |
| InChIKey | YGTBDPOXUGXCNN-UHFFFAOYSA-N |
Product Overview
2-(2H-Indazol-2-yl)aniline (CAS 54012-98-5), with molecular formula C13H11N3 and molecular weight 209.10 g/mol. IUPAC: 2-indazol-2-ylaniline.
Chemical Property Profile of 2-(2H-Indazol-2-yl)aniline
Property Insights of 2-(2H-Indazol-2-yl)aniline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2H-Indazol-2-yl)aniline. With a topological polar surface area (TPSA) of 43.8 Ų, 2-(2H-Indazol-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2H-Indazol-2-yl)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 2-(2H-Indazol-2-yl)aniline?
The CAS number of 2-(2H-Indazol-2-yl)aniline is 54012-98-5.
What is the molecular formula of 2-(2H-Indazol-2-yl)aniline?
The molecular formula of 2-(2H-Indazol-2-yl)aniline is C13H11N3.
What is the molecular weight of 2-(2H-Indazol-2-yl)aniline?
The molecular weight of 2-(2H-Indazol-2-yl)aniline is 209.10 g/mol.
Where can I buy 2-(2H-Indazol-2-yl)aniline?
You can request a quote for 2-(2H-Indazol-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2H-Indazol-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-(2H-Indazol-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.