(2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one
TL;DR: (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one (CAS 5706-18-3) 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.
(2E)-2-[(4-methylphenyl)methylidene]-3H-inden-1-one
Also Known As: 2-Isopropyliden-indan-1-on, p-methyl benzylidene-2 indanone, 2-(4-Methylbenzylidene)-1-indanone, 2-(p-methylbenzylindene)-1-indanone, 2-(4-Methylphenylmethylene)-1-indanone
| Molecular Formula | C17H14O |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 3.81742 |
| 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 | 632.9146 |
Chemical Identifiers
| CAS Number | 5706-18-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/2\CC3=CC=CC=C3C2=O |
Product Overview
(2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one (CAS 5706-18-3), with molecular formula C17H14O and molecular weight 234.10 g/mol. IUPAC: (2E)-2-[(4-methylphenyl)methylidene]-3H-inden-1-one.
Chemical Property Profile of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one
Property Insights of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one
The XLogP value of 3.81742 indicates that (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-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, (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-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 (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one?
The CAS number of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one is 5706-18-3.
What is the molecular formula of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one?
The molecular formula of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one is C17H14O.
What is the molecular weight of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one?
The molecular weight of (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one is 234.10 g/mol.
Where can I buy (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one?
You can request a quote for (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[(4-Methylphenyl)methylidene]-2,3-dihydro-1H-inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.