3-Benzalinden
TL;DR: 3-Benzalinden (CAS 5394-86-5) is a chemical compound with molecular formula C16H12 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylideneindene
Also Known As: 3-Benzalinden, 1-benzylideneindene, 1-benzylidene-1h-indene, (1E)-1-benzylideneindene
| Molecular Formula | C16H12 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.0939 |
| Heavy Atoms | 16 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 5394-86-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C=CC3=CC=CC=C32 |
| InChIKey | SJWIOZSGMUJDFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Benzalinden (CAS 5394-86-5), with molecular formula C16H12 and molecular weight 204.09 g/mol. IUPAC: 1-benzylideneindene.
Chemical Property Profile of 3-Benzalinden
Property Insights of 3-Benzalinden
The XLogP value of 4.3 indicates that 3-Benzalinden is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Benzalinden exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzalinden 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 3-Benzalinden?
The CAS number of 3-Benzalinden is 5394-86-5.
What is the molecular formula of 3-Benzalinden?
The molecular formula of 3-Benzalinden is C16H12.
What is the molecular weight of 3-Benzalinden?
The molecular weight of 3-Benzalinden is 204.09 g/mol.
Where can I buy 3-Benzalinden?
You can request a quote for 3-Benzalinden directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzalinden?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzalinden and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.