N-Phenyl-p-toluidine
TL;DR: N-Phenyl-p-toluidine (CAS 620-84-8) is a chemical compound with molecular formula C13H13N and molecular weight 183.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-phenylaniline
Also Known As: 4-Methyldiphenylamine, 4-methyl-N-phenylaniline, N-Phenyl-p-toluidine, Benzenamine, 4-methyl-N-phenyl-, n-4-tolylaniline
| Molecular Formula | C13H13N |
|---|---|
| Molecular Weight | 183.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.1048 |
| Heavy Atoms | 14 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 620-84-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=CC=CC=C2 |
| InChIKey | AGHYMXKKEXDUTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Phenyl-p-toluidine (CAS 620-84-8), with molecular formula C13H13N and molecular weight 183.10 g/mol. IUPAC: 4-methyl-N-phenylaniline.
Chemical Property Profile of N-Phenyl-p-toluidine
Property Insights of N-Phenyl-p-toluidine
The XLogP value of 3.9 indicates that N-Phenyl-p-toluidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-Phenyl-p-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Phenyl-p-toluidine has 1 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 N-Phenyl-p-toluidine?
The CAS number of N-Phenyl-p-toluidine is 620-84-8.
What is the molecular formula of N-Phenyl-p-toluidine?
The molecular formula of N-Phenyl-p-toluidine is C13H13N.
What is the molecular weight of N-Phenyl-p-toluidine?
The molecular weight of N-Phenyl-p-toluidine is 183.10 g/mol.
Where can I buy N-Phenyl-p-toluidine?
You can request a quote for N-Phenyl-p-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Phenyl-p-toluidine?
Yes, KEHONG BIO provides custom synthesis services for N-Phenyl-p-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.