5-((4-氨基苯基)甲基)-2-甲基苯胺
TL;DR: 5-((4-氨基苯基)甲基)-2-甲基苯胺 (CAS 79821-07-1) is a chemical compound with molecular formula C14H16N2 and molecular weight 212.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-((4-氨基苯基)甲基)-2-甲基苯胺
5-[(4-aminophenyl)methyl]-2-methylaniline
Also Known As: 3,4'-Diamino-4-methyldiphenylmethane, 5-[(4-aminophenyl)methyl]-2-methylaniline, 3,4'-diamino-4-methyl diphenyl methane, Benzenamine, 5-[(4-aminophenyl)methyl]-2-methyl-, 5-((4-Aminophenyl)methyl)-o-toluidine
| Molecular Formula | C14H16N2 |
|---|---|
| Molecular Weight | 212.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.13135 |
| Heavy Atoms | 16 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 79821-07-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)CC2=CC=C(C=C2)N)N |
| InChIKey | ZZWIUWXGJRSQIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-((4-氨基苯基)甲基)-2-甲基苯胺 (CAS 79821-07-1), with molecular formula C14H16N2 and molecular weight 212.13 g/mol. IUPAC: 5-[(4-aminophenyl)methyl]-2-methylaniline.
Chemical Property Profile of 5-((4-氨基苯基)甲基)-2-甲基苯胺
Property Insights of 5-((4-氨基苯基)甲基)-2-甲基苯胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((4-氨基苯基)甲基)-2-甲基苯胺. With a topological polar surface area (TPSA) of 52.0 Ų, 5-((4-氨基苯基)甲基)-2-甲基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-((4-氨基苯基)甲基)-2-甲基苯胺 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 5-((4-氨基苯基)甲基)-2-甲基苯胺?
The CAS number of 5-((4-氨基苯基)甲基)-2-甲基苯胺 is 79821-07-1.
What is the molecular formula of 5-((4-氨基苯基)甲基)-2-甲基苯胺?
The molecular formula of 5-((4-氨基苯基)甲基)-2-甲基苯胺 is C14H16N2.
What is the molecular weight of 5-((4-氨基苯基)甲基)-2-甲基苯胺?
The molecular weight of 5-((4-氨基苯基)甲基)-2-甲基苯胺 is 212.13 g/mol.
Where can I buy 5-((4-氨基苯基)甲基)-2-甲基苯胺?
You can request a quote for 5-((4-氨基苯基)甲基)-2-甲基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((4-氨基苯基)甲基)-2-甲基苯胺?
Yes, KEHONG BIO provides custom synthesis services for 5-((4-氨基苯基)甲基)-2-甲基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.