N-propyl-p-toluidine
TL;DR: N-propyl-p-toluidine (CAS 54837-90-0) is a chemical compound with molecular formula C10H15N and molecular weight 149.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-propylaniline
Also Known As: N-propyl-p-toluidine, 4-methyl-N-propylaniline, N-Propyl-p-toluidin, N-Propyl-4-methylaniline, Benzenamine,4-methyl-N-propyl-
| Molecular Formula | C10H15N |
|---|---|
| Molecular Weight | 149.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 149.12045 |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 54837-90-0 |
|---|---|
| SMILES | CCCNC1=CC=C(C=C1)C |
| InChIKey | YPEZCZIRPXYWSI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-propyl-p-toluidine (CAS 54837-90-0), with molecular formula C10H15N and molecular weight 149.12 g/mol. IUPAC: 4-methyl-N-propylaniline.
Chemical Property Profile of N-propyl-p-toluidine
Property Insights of N-propyl-p-toluidine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-propyl-p-toluidine. With a topological polar surface area (TPSA) of 12.0 Ų, N-propyl-p-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-propyl-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-propyl-p-toluidine?
The CAS number of N-propyl-p-toluidine is 54837-90-0.
What is the molecular formula of N-propyl-p-toluidine?
The molecular formula of N-propyl-p-toluidine is C10H15N.
What is the molecular weight of N-propyl-p-toluidine?
The molecular weight of N-propyl-p-toluidine is 149.12 g/mol.
Where can I buy N-propyl-p-toluidine?
You can request a quote for N-propyl-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-propyl-p-toluidine?
Yes, KEHONG BIO provides custom synthesis services for N-propyl-p-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.