2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone
TL;DR: 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone (CAS 5015-75-8) is a chemical compound with molecular formula C17H13ClO and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(4-chlorophenyl)methylidene]-3,4-dihydronaphthalen-1-one
Also Known As: 2-(4-Chlorophenylmethylene)-1-tetralone, 2-(4-Chlorobenzylidene)tetralin-1-one, (Z)-2-(4-Chlorobenzylidene)tetralin-1-one, (2Z)-2-(4-Chlorobenzylidene)tetralin-1-one, (2Z)-2-[(4-chlorophenyl)methylene]tetralin-1-one
| Molecular Formula | C17H13ClO |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 4.5525 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.0655 |
| Heavy Atoms | 19 |
| Complexity | 653.2172 |
Chemical Identifiers
| CAS Number | 5015-75-8 |
|---|---|
| SMILES | C1C/C(=C/C2=CC=C(C=C2)Cl)/C(=O)C3=CC=CC=C31 |
Product Overview
2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone (CAS 5015-75-8), with molecular formula C17H13ClO and molecular weight 268.07 g/mol. IUPAC: (2Z)-2-[(4-chlorophenyl)methylidene]-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone
Property Insights of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone
The XLogP value of 4.5525 indicates that 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone 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-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
The CAS number of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone is 5015-75-8.
What is the molecular formula of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
The molecular formula of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone is C17H13ClO.
What is the molecular weight of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
The molecular weight of 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone is 268.07 g/mol.
Where can I buy 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
You can request a quote for 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorobenzylidene)-3,4-dihydro-1(2H)-naphthalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.