Bis(4-aminophenyl)acetylene
TL;DR: Bis(4-aminophenyl)acetylene (CAS 6052-15-9) is a chemical compound with molecular formula C14H12N2 and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-aminophenyl)ethynyl]aniline
Also Known As: 4-[2-(4-aminophenyl)ethynyl]aniline, 4,4'-(Ethyne-1,2-diyl)dianiline, Bis(4-aminophenyl)acetylene, Diaminotolan, 4,4'-diphenylethynediamine
| Molecular Formula | C14H12N2 |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 2.2508 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.10005 |
| Heavy Atoms | 16 |
| Complexity | 478.1883 |
Chemical Identifiers
| CAS Number | 6052-15-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C#CC2=CC=C(C=C2)N)N |
Product Overview
Bis(4-aminophenyl)acetylene (CAS 6052-15-9), with molecular formula C14H12N2 and molecular weight 208.10 g/mol. IUPAC: 4-[2-(4-aminophenyl)ethynyl]aniline.
Chemical Property Profile of Bis(4-aminophenyl)acetylene
Property Insights of Bis(4-aminophenyl)acetylene
The XLogP value of 2.2508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(4-aminophenyl)acetylene. With a topological polar surface area (TPSA) of 52.04 Ų, Bis(4-aminophenyl)acetylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(4-aminophenyl)acetylene has 2 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 Bis(4-aminophenyl)acetylene?
The CAS number of Bis(4-aminophenyl)acetylene is 6052-15-9.
What is the molecular formula of Bis(4-aminophenyl)acetylene?
The molecular formula of Bis(4-aminophenyl)acetylene is C14H12N2.
What is the molecular weight of Bis(4-aminophenyl)acetylene?
The molecular weight of Bis(4-aminophenyl)acetylene is 208.10 g/mol.
Where can I buy Bis(4-aminophenyl)acetylene?
You can request a quote for Bis(4-aminophenyl)acetylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(4-aminophenyl)acetylene?
Yes, KEHONG BIO provides custom synthesis services for Bis(4-aminophenyl)acetylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.