2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol
TL;DR: 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol (CAS 84611-65-4) is a chemical compound with molecular formula C17H15Cl2NO and molecular weight 319.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-but-3-enyl-C-(2-chlorophenyl)carbonimidoyl]-4-chlorophenol
Also Known As: Phenol,2-( -4-chloro-, 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol, Phenol, 2-((3-butenylimino)(2-chlorophenyl)methyl)-4-chloro-, (6E)-6-[(but-3-enylamino)-(2-chlorophenyl)methylidene]-4-chlorocyclohexa-2,4-dien-1-one, (6E)-6-[[[(E)-but-2-enyl]amino]-(2-chlorophenyl)methylidene]-4-chlorocyclohexa-2,4-dien-1-one
| Molecular Formula | C17H15Cl2NO |
|---|---|
| Molecular Weight | 319.05 g/mol |
| LogP | 5.1125 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.05307 |
| Heavy Atoms | 21 |
| Complexity | 680.24036 |
Chemical Identifiers
| CAS Number | 84611-65-4 |
|---|---|
| SMILES | C=CCCN=C(C1=CC=CC=C1Cl)C2=C(C=CC(=C2)Cl)O |
Product Overview
2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol (CAS 84611-65-4), with molecular formula C17H15Cl2NO and molecular weight 319.05 g/mol. IUPAC: 2-[N-but-3-enyl-C-(2-chlorophenyl)carbonimidoyl]-4-chlorophenol.
Chemical Property Profile of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol
Property Insights of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol
The XLogP value of 5.1125 indicates that 2-((3-Butenylimino)(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-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((3-Butenylimino)(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-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol?
The CAS number of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol is 84611-65-4.
What is the molecular formula of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol?
The molecular formula of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol is C17H15Cl2NO.
What is the molecular weight of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol?
The molecular weight of 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol is 319.05 g/mol.
Where can I buy 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol?
You can request a quote for 2-((3-Butenylimino)(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-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-Butenylimino)(2-chlorophenyl)methyl)-4-chlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.