2-Benzylidenetetralone
TL;DR: 2-Benzylidenetetralone (CAS 57558-64-2) is a chemical compound with molecular formula C17H14O and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-benzylidene-3,4-dihydronaphthalen-1-one
Also Known As: 2-Benzylidene-1-tetralone, 2-Benzylidenetetralone, (2Z)-2-benzylidenetetralin-1-one, (2Z)-2-benzylidene-3,4-dihydronaphthalen-1-one, (2Z)-2-(phenylmethylidene)-1,2,3,4-tetrahydronaphthalen-1-one
| Molecular Formula | C17H14O |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 3.8991 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.10446 |
| Heavy Atoms | 18 |
| Complexity | 608.517 |
Chemical Identifiers
| CAS Number | 57558-64-2 |
|---|---|
| SMILES | C1C/C(=C/C2=CC=CC=C2)/C(=O)C3=CC=CC=C31 |
Product Overview
2-Benzylidenetetralone (CAS 57558-64-2), with molecular formula C17H14O and molecular weight 234.10 g/mol. IUPAC: (2Z)-2-benzylidene-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of 2-Benzylidenetetralone
Property Insights of 2-Benzylidenetetralone
The XLogP value of 3.8991 indicates that 2-Benzylidenetetralone 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-Benzylidenetetralone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzylidenetetralone 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-Benzylidenetetralone?
The CAS number of 2-Benzylidenetetralone is 57558-64-2.
What is the molecular formula of 2-Benzylidenetetralone?
The molecular formula of 2-Benzylidenetetralone is C17H14O.
What is the molecular weight of 2-Benzylidenetetralone?
The molecular weight of 2-Benzylidenetetralone is 234.10 g/mol.
Where can I buy 2-Benzylidenetetralone?
You can request a quote for 2-Benzylidenetetralone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzylidenetetralone?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylidenetetralone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.