3-((4-Aminocyclohexyl)methyl)-p-toluidine
TL;DR: 3-((4-Aminocyclohexyl)methyl)-p-toluidine (CAS 85586-59-0) is a chemical compound with molecular formula C14H22N2 and molecular weight 218.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-aminocyclohexyl)methyl]-4-methylaniline
Also Known As: EINECS 287-863-9, 3-((4-Aminocyclohexyl)methyl)-p-toluidine, 3-[(4-aminocyclohexyl)methyl]-4-methylaniline, 3-[(4-aminocyclohexyl)methyl]-p-toluidine, 4-((2-Aminocyclohexyl)methyl)-o-toluidine
| Molecular Formula | C14H22N2 |
|---|---|
| Molecular Weight | 218.18 g/mol |
| LogP | 2.63722 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.1783 |
| Heavy Atoms | 16 |
| Complexity | 351.75302 |
Chemical Identifiers
| CAS Number | 85586-59-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N)CC2CCC(CC2)N |
Product Overview
3-((4-Aminocyclohexyl)methyl)-p-toluidine (CAS 85586-59-0), with molecular formula C14H22N2 and molecular weight 218.18 g/mol. IUPAC: 3-[(4-aminocyclohexyl)methyl]-4-methylaniline.
Chemical Property Profile of 3-((4-Aminocyclohexyl)methyl)-p-toluidine
Property Insights of 3-((4-Aminocyclohexyl)methyl)-p-toluidine
The XLogP value of 2.63722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((4-Aminocyclohexyl)methyl)-p-toluidine. With a topological polar surface area (TPSA) of 52.04 Ų, 3-((4-Aminocyclohexyl)methyl)-p-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((4-Aminocyclohexyl)methyl)-p-toluidine has 2 hydrogen bond donor(s) and 2 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-Aminocyclohexyl)methyl)-p-toluidine?
The CAS number of 3-((4-Aminocyclohexyl)methyl)-p-toluidine is 85586-59-0.
What is the molecular formula of 3-((4-Aminocyclohexyl)methyl)-p-toluidine?
The molecular formula of 3-((4-Aminocyclohexyl)methyl)-p-toluidine is C14H22N2.
What is the molecular weight of 3-((4-Aminocyclohexyl)methyl)-p-toluidine?
The molecular weight of 3-((4-Aminocyclohexyl)methyl)-p-toluidine is 218.18 g/mol.
Where can I buy 3-((4-Aminocyclohexyl)methyl)-p-toluidine?
You can request a quote for 3-((4-Aminocyclohexyl)methyl)-p-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-Aminocyclohexyl)methyl)-p-toluidine?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-Aminocyclohexyl)methyl)-p-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.