4-((1H-Inden-1-ylidene)methyl)aniline
TL;DR: 4-((1H-Inden-1-ylidene)methyl)aniline (CAS 487-61-6) is a chemical compound with molecular formula C16H13N and molecular weight 219.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(inden-1-ylidenemethyl)aniline
Also Known As: NCIOpen2_004536, 1-(4-Aminobenzylidene)indene, 4-(inden-1-ylidenemethyl)aniline, alpha-Inden-1-ylidene-p-toluidine, 4-((1H-Inden-1-ylidene)methyl)aniline
| Molecular Formula | C16H13N |
|---|---|
| Molecular Weight | 219.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.1048 |
| Heavy Atoms | 17 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 487-61-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC2=CC3=CC=C(C=C3)N |
| InChIKey | GISMNWZLKDONAA-UHFFFAOYSA-N |
Product Overview
4-((1H-Inden-1-ylidene)methyl)aniline (CAS 487-61-6), with molecular formula C16H13N and molecular weight 219.10 g/mol. IUPAC: 4-(inden-1-ylidenemethyl)aniline.
Chemical Property Profile of 4-((1H-Inden-1-ylidene)methyl)aniline
Property Insights of 4-((1H-Inden-1-ylidene)methyl)aniline
The XLogP value of 3.6 indicates that 4-((1H-Inden-1-ylidene)methyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 4-((1H-Inden-1-ylidene)methyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((1H-Inden-1-ylidene)methyl)aniline 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 4-((1H-Inden-1-ylidene)methyl)aniline?
The CAS number of 4-((1H-Inden-1-ylidene)methyl)aniline is 487-61-6.
What is the molecular formula of 4-((1H-Inden-1-ylidene)methyl)aniline?
The molecular formula of 4-((1H-Inden-1-ylidene)methyl)aniline is C16H13N.
What is the molecular weight of 4-((1H-Inden-1-ylidene)methyl)aniline?
The molecular weight of 4-((1H-Inden-1-ylidene)methyl)aniline is 219.10 g/mol.
Where can I buy 4-((1H-Inden-1-ylidene)methyl)aniline?
You can request a quote for 4-((1H-Inden-1-ylidene)methyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1H-Inden-1-ylidene)methyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-((1H-Inden-1-ylidene)methyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.