二苯醚
TL;DR: 二苯醚 (CAS 101-84-8) is a chemical compound with molecular formula C12H10O and molecular weight 170.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯醚
phenoxybenzene
Also Known As: DIPHENYL ETHER, Diphenyl oxide, Phenoxybenzene, Phenyl ether, Diphenylether
| Molecular Formula | C12H10O |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.07317 |
| Heavy Atoms | 13 |
| Complexity | 116.0 |
| Melting Point | 26.8 °C |
| Boiling Point | 257.9 °C at 760 mmHg |
| Density | 1.07 at 27.0 °C |
| Solubility | Insoluble (NTP, 1992) |
| Flash Point | 115.0 °C |
| Vapor Pressure | 0.02 mmHg at 25.0 °C |
| Refractive Index | 1.5787 at 25 °C |
Chemical Identifiers
| CAS Number | 101-84-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC=C2 |
| InChIKey | USIUVYZYUHIAEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二苯醚 (CAS 101-84-8), with molecular formula C12H10O and molecular weight 170.07 g/mol. IUPAC: phenoxybenzene.
Chemical Property Profile of 二苯醚
Property Insights of 二苯醚
The XLogP value of 4.2 indicates that 二苯醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 二苯醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二苯醚 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 二苯醚?
The CAS number of 二苯醚 is 101-84-8.
What is the molecular formula of 二苯醚?
The molecular formula of 二苯醚 is C12H10O.
What is the molecular weight of 二苯醚?
The molecular weight of 二苯醚 is 170.07 g/mol.
Where can I buy 二苯醚?
You can request a quote for 二苯醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯醚?
Yes, KEHONG BIO provides custom synthesis services for 二苯醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.