2-硝基联苯
TL;DR: 2-硝基联苯 (CAS 86-00-0) is a chemical compound with molecular formula C12H9NO2 and molecular weight 199.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-硝基联苯
1-nitro-2-phenylbenzene
Also Known As: 2-Nitrobiphenyl, 2-Nitrodiphenyl, o-Nitrodiphenyl, 2-Nitro-1,1'-biphenyl, O-NITROBIPHENYL
| Molecular Formula | C12H9NO2 |
|---|---|
| Molecular Weight | 199.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 199.06332 |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
| Melting Point | 97 to 37.8 °C |
| Boiling Point | 320.0 °C at 760 mmHg |
| Density | 1.203 at 25.0 °C |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Flash Point | 143.3 °C |
| Vapor Pressure | 2 mmHg at 140.0 °C |
Chemical Identifiers
| CAS Number | 86-00-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | YOJKKXRJMXIKSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-硝基联苯 (CAS 86-00-0), with molecular formula C12H9NO2 and molecular weight 199.06 g/mol. IUPAC: 1-nitro-2-phenylbenzene.
Chemical Property Profile of 2-硝基联苯
Property Insights of 2-硝基联苯
The XLogP value of 3.7 indicates that 2-硝基联苯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 2-硝基联苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-硝基联苯 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 2-硝基联苯?
The CAS number of 2-硝基联苯 is 86-00-0.
What is the molecular formula of 2-硝基联苯?
The molecular formula of 2-硝基联苯 is C12H9NO2.
What is the molecular weight of 2-硝基联苯?
The molecular weight of 2-硝基联苯 is 199.06 g/mol.
Where can I buy 2-硝基联苯?
You can request a quote for 2-硝基联苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-硝基联苯?
Yes, KEHONG BIO provides custom synthesis services for 2-硝基联苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.