2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol
TL;DR: 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol (CAS 80018-30-0) is a chemical compound with molecular formula C19H21Cl2NO and molecular weight 349.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[C-(2-chlorophenyl)-N-(3,3-dimethylbutyl)carbonimidoyl]phenol
Also Known As: 4-Chloro-2-( ( phenol, 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol, 4-Chloro-2-((2-chlorophenyl)((3,3-dimethylbutyl)imino)methyl)phenol, Phenol, 4-chloro-2-((2-chlorophenyl)((3,3-dimethylbutyl)imino)methyl)-, Phenol,4-chloro-2-[(2-chlorophenyl)[(3,3-dimethylbutyl)imino]methyl]-
| Molecular Formula | C19H21Cl2NO |
|---|---|
| Molecular Weight | 349.10 g/mol |
| LogP | 5.9726 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.1 |
| Heavy Atoms | 23 |
| Complexity | 717.5498 |
Chemical Identifiers
| CAS Number | 80018-30-0 |
|---|---|
| SMILES | CC(C)(C)CCN=C(C1=CC=CC=C1Cl)C2=C(C=CC(=C2)Cl)O |
Product Overview
2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol (CAS 80018-30-0), with molecular formula C19H21Cl2NO and molecular weight 349.10 g/mol. IUPAC: 4-chloro-2-[C-(2-chlorophenyl)-N-(3,3-dimethylbutyl)carbonimidoyl]phenol.
Chemical Property Profile of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol
Property Insights of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol
The XLogP value of 5.9726 indicates that 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.59 Ų, 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol?
The CAS number of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol is 80018-30-0.
What is the molecular formula of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol?
The molecular formula of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol is C19H21Cl2NO.
What is the molecular weight of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol?
The molecular weight of 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol is 349.10 g/mol.
Where can I buy 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol?
You can request a quote for 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,3-Dimethylbutyl)imino-(2-chlorophenyl)methyl)-4-chlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.