1,3-Diphenyl-2-methyl-1,3-propandione
TL;DR: 1,3-Diphenyl-2-methyl-1,3-propandione (CAS 1846-29-3) is a chemical compound with molecular formula C16H14O2 and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1,3-diphenylpropane-1,3-dione
Also Known As: Dibenzoylethane, 2-methyl-1,3-diphenylpropane-1,3-dione, dibenzoyl ethane, 1,1-Dibenzoylethane, 1,3-diphenyl-2-methyl-1,3-propandione
| Molecular Formula | C16H14O2 |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.09938 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 1846-29-3 |
|---|---|
| SMILES | CC(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2 |
| InChIKey | ONGBXISBKSVVFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Diphenyl-2-methyl-1,3-propandione (CAS 1846-29-3), with molecular formula C16H14O2 and molecular weight 238.10 g/mol. IUPAC: 2-methyl-1,3-diphenylpropane-1,3-dione.
Chemical Property Profile of 1,3-Diphenyl-2-methyl-1,3-propandione
Property Insights of 1,3-Diphenyl-2-methyl-1,3-propandione
The XLogP value of 3.8 indicates that 1,3-Diphenyl-2-methyl-1,3-propandione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1,3-Diphenyl-2-methyl-1,3-propandione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diphenyl-2-methyl-1,3-propandione 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 1,3-Diphenyl-2-methyl-1,3-propandione?
The CAS number of 1,3-Diphenyl-2-methyl-1,3-propandione is 1846-29-3.
What is the molecular formula of 1,3-Diphenyl-2-methyl-1,3-propandione?
The molecular formula of 1,3-Diphenyl-2-methyl-1,3-propandione is C16H14O2.
What is the molecular weight of 1,3-Diphenyl-2-methyl-1,3-propandione?
The molecular weight of 1,3-Diphenyl-2-methyl-1,3-propandione is 238.10 g/mol.
Where can I buy 1,3-Diphenyl-2-methyl-1,3-propandione?
You can request a quote for 1,3-Diphenyl-2-methyl-1,3-propandione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diphenyl-2-methyl-1,3-propandione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diphenyl-2-methyl-1,3-propandione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.