3-(4-Methylphenyl)aniline
TL;DR: 3-(4-Methylphenyl)aniline (CAS 400751-16-8) 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.
3-(4-methylphenyl)aniline
Also Known As: 3-(4-methylphenyl)aniline, 4'-Methyl-[1,1'-biphenyl]-3-amine, 3-(p-tolyl)aniline, 4'-Methyl-biphenyl-3-amine, (4'-methylbiphenyl-3-yl)amine
| Molecular Formula | C13H13N |
|---|---|
| Molecular Weight | 183.10 g/mol |
| LogP | 3.24422 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.1048 |
| Heavy Atoms | 14 |
| Complexity | 429.24347 |
Chemical Identifiers
| CAS Number | 400751-16-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=CC=C2)N |
Product Overview
3-(4-Methylphenyl)aniline (CAS 400751-16-8), with molecular formula C13H13N and molecular weight 183.10 g/mol. IUPAC: 3-(4-methylphenyl)aniline.
Chemical Property Profile of 3-(4-Methylphenyl)aniline
Property Insights of 3-(4-Methylphenyl)aniline
The XLogP value of 3.24422 indicates that 3-(4-Methylphenyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 3-(4-Methylphenyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methylphenyl)aniline 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 3-(4-Methylphenyl)aniline?
The CAS number of 3-(4-Methylphenyl)aniline is 400751-16-8.
What is the molecular formula of 3-(4-Methylphenyl)aniline?
The molecular formula of 3-(4-Methylphenyl)aniline is C13H13N.
What is the molecular weight of 3-(4-Methylphenyl)aniline?
The molecular weight of 3-(4-Methylphenyl)aniline is 183.10 g/mol.
Where can I buy 3-(4-Methylphenyl)aniline?
You can request a quote for 3-(4-Methylphenyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methylphenyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylphenyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.