Benzenamine, N-(1,1-dimethylethyl)-4-methyl-
TL;DR: Benzenamine, N-(1,1-dimethylethyl)-4-methyl- (CAS 10219-31-5) is a chemical compound with molecular formula C11H17N and molecular weight 163.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-4-methylaniline
Also Known As: N-tert-butyl-4-methylaniline, N-(tert-Butyl)-4-methylaniline, N-tert-Butyl-p-methylaniline, 4-Methyl-N-tert-butylaniline, Aniline, 4-methyl-N-tert-butyl-
| Molecular Formula | C11H17N |
|---|---|
| Molecular Weight | 163.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.1361 |
| Heavy Atoms | 12 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 10219-31-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(C)(C)C |
| InChIKey | XVOOKSRPDMBTAI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, N-(1,1-dimethylethyl)-4-methyl- (CAS 10219-31-5), with molecular formula C11H17N and molecular weight 163.14 g/mol. IUPAC: N-tert-butyl-4-methylaniline.
Chemical Property Profile of Benzenamine, N-(1,1-dimethylethyl)-4-methyl-
Property Insights of Benzenamine, N-(1,1-dimethylethyl)-4-methyl-
The XLogP value of 3.1 indicates that Benzenamine, N-(1,1-dimethylethyl)-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Benzenamine, N-(1,1-dimethylethyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N-(1,1-dimethylethyl)-4-methyl- 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 Benzenamine, N-(1,1-dimethylethyl)-4-methyl-?
The CAS number of Benzenamine, N-(1,1-dimethylethyl)-4-methyl- is 10219-31-5.
What is the molecular formula of Benzenamine, N-(1,1-dimethylethyl)-4-methyl-?
The molecular formula of Benzenamine, N-(1,1-dimethylethyl)-4-methyl- is C11H17N.
What is the molecular weight of Benzenamine, N-(1,1-dimethylethyl)-4-methyl-?
The molecular weight of Benzenamine, N-(1,1-dimethylethyl)-4-methyl- is 163.14 g/mol.
Where can I buy Benzenamine, N-(1,1-dimethylethyl)-4-methyl-?
You can request a quote for Benzenamine, N-(1,1-dimethylethyl)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, N-(1,1-dimethylethyl)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, N-(1,1-dimethylethyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.