(3E)-4-(Naphthalen-1-YL)but-3-EN-2-one
TL;DR: (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one (CAS 66920-75-0) is a chemical compound with molecular formula C14H12O and molecular weight 196.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-naphthalen-1-ylbut-3-en-2-one
Also Known As: 4-(1-Naphthyl)-3-buten-2-one, EINECS 257-285-1, 4-(1-Naphthalenyl)-3-buten-2-one, (E)-4-(1-Naphthyl)-3-buten-2-one, (e)-4-(naphthalen-1-yl)but-3-en-2-one
| Molecular Formula | C14H12O |
|---|---|
| Molecular Weight | 196.09 g/mol |
| LogP | 3.442 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.08882 |
| Heavy Atoms | 15 |
| Complexity | 518.3547 |
Chemical Identifiers
| CAS Number | 66920-75-0 |
|---|---|
| SMILES | CC(=O)C=CC1=CC=CC2=CC=CC=C21 |
Product Overview
(3E)-4-(Naphthalen-1-YL)but-3-EN-2-one (CAS 66920-75-0), with molecular formula C14H12O and molecular weight 196.09 g/mol. IUPAC: 4-naphthalen-1-ylbut-3-en-2-one.
Chemical Property Profile of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one
Property Insights of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one
The XLogP value of 3.442 indicates that (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one 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 (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one?
The CAS number of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one is 66920-75-0.
What is the molecular formula of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one?
The molecular formula of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one is C14H12O.
What is the molecular weight of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one?
The molecular weight of (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one is 196.09 g/mol.
Where can I buy (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one?
You can request a quote for (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-4-(Naphthalen-1-YL)but-3-EN-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.