1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine
TL;DR: 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine (CAS 49707-52-0) is a chemical compound with molecular formula C15H23N and molecular weight 217.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine
Also Known As: 1-phenyl-N- methanimine, N-Benzylidene-1,1,3,3-tetramethyl-1-butaneamine, J3.032.996A, 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine, 2,4,4-trimethyl-n-[(e)-phenylmethylidene]pentan-2-amine
| Molecular Formula | C15H23N |
|---|---|
| Molecular Weight | 217.18 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.18304 |
| Heavy Atoms | 16 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 49707-52-0 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)N=CC1=CC=CC=C1 |
| InChIKey | IFZQMWYTFOSJPZ-UHFFFAOYSA-N |
Product Overview
1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine (CAS 49707-52-0), with molecular formula C15H23N and molecular weight 217.18 g/mol. IUPAC: 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine.
Chemical Property Profile of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine
Property Insights of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine
The XLogP value of 4.2 indicates that 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine has 0 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 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine?
The CAS number of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine is 49707-52-0.
What is the molecular formula of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine?
The molecular formula of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine is C15H23N.
What is the molecular weight of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine?
The molecular weight of 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine is 217.18 g/mol.
Where can I buy 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine?
You can request a quote for 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.