2-Propyn-1-one, 1-(2-naphthalenyl)-
TL;DR: 2-Propyn-1-one, 1-(2-naphthalenyl)- (CAS 404839-10-7) is a chemical compound with molecular formula C13H8O and molecular weight 180.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-naphthalen-2-ylprop-2-yn-1-one
Also Known As: 2-Propyn-1-one, 1-(2-naphthalenyl)-, 1-naphthalen-2-ylprop-2-yn-1-one, 1-(2-Naphthyl)-2-propyne-1-one, 1-(NAPHTHALEN-2-YL)PROP-2-YN-1-ONE, 2-Propyn-1-one,1-(2-naphthalenyl)
| Molecular Formula | C13H8O |
|---|---|
| Molecular Weight | 180.06 g/mol |
| LogP | 2.6557 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.05751 |
| Heavy Atoms | 14 |
| Complexity | 532.172 |
Chemical Identifiers
| CAS Number | 404839-10-7 |
|---|---|
| SMILES | C#CC(=O)C1=CC2=CC=CC=C2C=C1 |
Product Overview
2-Propyn-1-one, 1-(2-naphthalenyl)- (CAS 404839-10-7), with molecular formula C13H8O and molecular weight 180.06 g/mol. IUPAC: 1-naphthalen-2-ylprop-2-yn-1-one.
Chemical Property Profile of 2-Propyn-1-one, 1-(2-naphthalenyl)-
Property Insights of 2-Propyn-1-one, 1-(2-naphthalenyl)-
The XLogP value of 2.6557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propyn-1-one, 1-(2-naphthalenyl)-. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Propyn-1-one, 1-(2-naphthalenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propyn-1-one, 1-(2-naphthalenyl)- has 0 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 2-Propyn-1-one, 1-(2-naphthalenyl)-?
The CAS number of 2-Propyn-1-one, 1-(2-naphthalenyl)- is 404839-10-7.
What is the molecular formula of 2-Propyn-1-one, 1-(2-naphthalenyl)-?
The molecular formula of 2-Propyn-1-one, 1-(2-naphthalenyl)- is C13H8O.
What is the molecular weight of 2-Propyn-1-one, 1-(2-naphthalenyl)-?
The molecular weight of 2-Propyn-1-one, 1-(2-naphthalenyl)- is 180.06 g/mol.
Where can I buy 2-Propyn-1-one, 1-(2-naphthalenyl)-?
You can request a quote for 2-Propyn-1-one, 1-(2-naphthalenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propyn-1-one, 1-(2-naphthalenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propyn-1-one, 1-(2-naphthalenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.