Anthracene, 2-ethynyl-
TL;DR: Anthracene, 2-ethynyl- (CAS 78053-56-2) is a chemical compound with molecular formula C16H10 and molecular weight 202.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethynylanthracene
Also Known As: 2-ethynylanthracene, Anthracene, 2-ethynyl-, Anthracene,2-ethynyl, (2-Anthryl)acetylene
| Molecular Formula | C16H10 |
|---|---|
| Molecular Weight | 202.08 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.07825 |
| Heavy Atoms | 16 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 78053-56-2 |
|---|---|
| SMILES | C#CC1=CC2=CC3=CC=CC=C3C=C2C=C1 |
| InChIKey | DGHUTFJRBDDVFF-UHFFFAOYSA-N |
Product Overview
Anthracene, 2-ethynyl- (CAS 78053-56-2), with molecular formula C16H10 and molecular weight 202.08 g/mol. IUPAC: 2-ethynylanthracene.
Chemical Property Profile of Anthracene, 2-ethynyl-
Property Insights of Anthracene, 2-ethynyl-
The XLogP value of 5.0 indicates that Anthracene, 2-ethynyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Anthracene, 2-ethynyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anthracene, 2-ethynyl- has 0 hydrogen bond donor(s) and 0 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 Anthracene, 2-ethynyl-?
The CAS number of Anthracene, 2-ethynyl- is 78053-56-2.
What is the molecular formula of Anthracene, 2-ethynyl-?
The molecular formula of Anthracene, 2-ethynyl- is C16H10.
What is the molecular weight of Anthracene, 2-ethynyl-?
The molecular weight of Anthracene, 2-ethynyl- is 202.08 g/mol.
Where can I buy Anthracene, 2-ethynyl-?
You can request a quote for Anthracene, 2-ethynyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthracene, 2-ethynyl-?
Yes, KEHONG BIO provides custom synthesis services for Anthracene, 2-ethynyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.