4-亚硝基二苯胺
TL;DR: 4-亚硝基二苯胺 (CAS 156-10-5) is a chemical compound with molecular formula C12H10N2O and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-亚硝基二苯胺
4-nitroso-N-phenylaniline
Also Known As: 4-NITROSODIPHENYLAMINE, 4-Nitroso-N-phenylaniline, p-Nitrosodiphenylamine, Naugard TKB, p-Nitrosodifenylamin
| Molecular Formula | C12H10N2O |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.07932 |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
| Melting Point | 143.9 °C (Decomposes) |
| Solubility | less than 0.1 mg/mL at 70.7 °F (NTP, 1992) |
| Vapor Pressure | 0.000185 [mmHg] |
Chemical Identifiers
| CAS Number | 156-10-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC=C(C=C2)N=O |
| InChIKey | OIJHFHYPXWSVPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-亚硝基二苯胺 (CAS 156-10-5), with molecular formula C12H10N2O and molecular weight 198.08 g/mol. IUPAC: 4-nitroso-N-phenylaniline.
Chemical Property Profile of 4-亚硝基二苯胺
Property Insights of 4-亚硝基二苯胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-亚硝基二苯胺. With a topological polar surface area (TPSA) of 41.5 Ų, 4-亚硝基二苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-亚硝基二苯胺 has 1 hydrogen bond donor(s) and 3 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 4-亚硝基二苯胺?
The CAS number of 4-亚硝基二苯胺 is 156-10-5.
What is the molecular formula of 4-亚硝基二苯胺?
The molecular formula of 4-亚硝基二苯胺 is C12H10N2O.
What is the molecular weight of 4-亚硝基二苯胺?
The molecular weight of 4-亚硝基二苯胺 is 198.08 g/mol.
Where can I buy 4-亚硝基二苯胺?
You can request a quote for 4-亚硝基二苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-亚硝基二苯胺?
Yes, KEHONG BIO provides custom synthesis services for 4-亚硝基二苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.