1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-
TL;DR: 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- (CAS 135193-39-4) is a chemical compound with molecular formula C15H26N2 and molecular weight 234.2096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-N,4-ditert-butyl-2-methylbenzene-1,3-diamine
Also Known As: 2-N-3-Di-tert-butyl-2,6-toluenediamine, 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-, J1.565.171G, 3-N,4-ditert-butyl-2-methylbenzene-1,3-diamine, N ,4-Di-tert-butyl-2-methyl-1,3-benzenediamine
Technical Specifications
| Molecular Formula | C15H26N2 |
| Molecular Weight | 234.2096 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.2096 Da |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
| SMILES | CC1=C(C=CC(=C1NC(C)(C)C)C(C)(C)C)N |
| InChIKey | BTTJULQCEAEJBU-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-
Property Insights of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-
The XLogP value of 4.2 indicates that 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.1 Ų, 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- 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
What is the CAS number of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-?
The CAS number of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- is 135193-39-4.
What is the molecular formula of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-?
The molecular formula of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- is C15H26N2.
What is the molecular weight of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-?
The molecular weight of 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- is 234.2096 g/mol.
Where can I buy 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-?
You can request a quote for 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl-?
Yes, CoreyChem provides custom synthesis services for 1,3-Benzenediamine, N3,4-bis(1,1-dimethylethyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.