1-Phenyl-2-(phenylmethylidene)butane-1,3-dione
TL;DR: 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione (CAS 25354-72-7) is a chemical compound with molecular formula C17H14O2 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-benzylidene-1-phenylbutane-1,3-dione
Also Known As: 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione, 1-Phenyl-2-benzylidenebutane-1,3-dione, 2-benzylidene-1-phenylbutane-1,3-dione, (2E)-2-benzylidene-1-phenylbutane-1,3-dione, (2E)-1-phenyl-2-(phenylmethylidene)butane-1,3-dione
| Molecular Formula | C17H14O2 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 3.5419 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.09938 |
| Heavy Atoms | 19 |
| Complexity | 610.22504 |
Chemical Identifiers
| CAS Number | 25354-72-7 |
|---|---|
| SMILES | CC(=O)/C(=C\C1=CC=CC=C1)/C(=O)C2=CC=CC=C2 |
Product Overview
1-Phenyl-2-(phenylmethylidene)butane-1,3-dione (CAS 25354-72-7), with molecular formula C17H14O2 and molecular weight 250.10 g/mol. IUPAC: (2E)-2-benzylidene-1-phenylbutane-1,3-dione.
Chemical Property Profile of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione
Property Insights of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione
The XLogP value of 3.5419 indicates that 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione has 0 hydrogen bond donor(s) and 2 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 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione?
The CAS number of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione is 25354-72-7.
What is the molecular formula of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione?
The molecular formula of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione is C17H14O2.
What is the molecular weight of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione?
The molecular weight of 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione is 250.10 g/mol.
Where can I buy 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione?
You can request a quote for 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-(phenylmethylidene)butane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.