Diphenylmethane
TL;DR: Diphenylmethane (CAS 101-81-5) is a chemical compound with molecular formula C13H12 and molecular weight 168.0939 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzylbenzene
Also Known As: Diphenylmethane, Benzylbenzene, Ditan, Ditane, Diphenyl methane
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H12 |
| Molecular Weight | 168.0939 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.0939 Da |
| Heavy Atoms | 13 |
| Complexity | 111.0 |
| Melting Point | 25.4 °C |
| Boiling Point | 264.5 °C |
| Density | 1.3421 at 10 °C/4 °C (solid); 1.0008 at 26 °C/4 °C (liquid) |
| Flash Point | 130 °C |
| Vapor Pressure | 0.00821 [mmHg] |
| Refractive Index | Index of refraction: 1.57683 at 20 °C/D |
| Solubility | In water, 14.1 mg/L at 25 °C |
| SMILES | C1=CC=C(C=C1)CC2=CC=CC=C2 |
| InChIKey | CZZYITDELCSZES-UHFFFAOYSA-N |
Product Description
Applications: Diphenylmethane is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Diphenylmethane (CAS 101-81-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Diphenylmethane is a heterocyclic building block identified by CAS number 101-81-5 and the molecular formula C13H12 and a molecular weight of 168.09 g/mol. Physically, the compound has a density of 1.3421 at 10 °C/4 °C (solid); 1.0008 at 26 °C/4 °C (liquid) g/cm³, a solubility: In water, 14.1 mg/L at 25 °C. It is also known as Diphenylmethane and Benzylbenzene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Diphenylmethane
Property Insights of Diphenylmethane
The XLogP value of 4.1 indicates that Diphenylmethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Diphenylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenylmethane 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
What is the CAS number of Diphenylmethane?
The CAS number of Diphenylmethane is 101-81-5.
What is the molecular formula of Diphenylmethane?
The molecular formula of Diphenylmethane is C13H12.
What is the molecular weight of Diphenylmethane?
The molecular weight of Diphenylmethane is 168.0939 g/mol.
What are the applications of Diphenylmethane?
Diphenylmethane is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Diphenylmethane (CAS 101-81-5) with...
Where can I buy Diphenylmethane?
You can request a quote for Diphenylmethane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diphenylmethane?
Yes, CoreyChem provides custom synthesis services for Diphenylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.