Methyldiphenylamine
TL;DR: Methyldiphenylamine (CAS 552-82-9) 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.
N-methyl-N-phenylaniline
Also Known As: N-Methyldiphenylamine, N-Methyl-N-phenylaniline, METHYLDIPHENYLAMINE, Diphenylmethylamine, Benzenamine, N-methyl-N-phenyl-
| Molecular Formula | C13H13N |
|---|---|
| Molecular Weight | 183.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.1048 |
| Heavy Atoms | 14 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 552-82-9 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | DYFFAVRFJWYYQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyldiphenylamine (CAS 552-82-9), with molecular formula C13H13N and molecular weight 183.10 g/mol. IUPAC: N-methyl-N-phenylaniline.
Chemical Property Profile of Methyldiphenylamine
Property Insights of Methyldiphenylamine
The XLogP value of 3.9 indicates that Methyldiphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Methyldiphenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyldiphenylamine 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 Methyldiphenylamine?
The CAS number of Methyldiphenylamine is 552-82-9.
What is the molecular formula of Methyldiphenylamine?
The molecular formula of Methyldiphenylamine is C13H13N.
What is the molecular weight of Methyldiphenylamine?
The molecular weight of Methyldiphenylamine is 183.10 g/mol.
Where can I buy Methyldiphenylamine?
You can request a quote for Methyldiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyldiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for Methyldiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.