Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-
TL;DR: Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- (CAS 105533-42-4) is a chemical compound with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[N-(4-ethoxyphenyl)-C-methylcarbonimidoyl]phenol
Also Known As: 7-Benzyl-7H-tetrazolo<5,1-i>purin, Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-, 4-chloro-6-[1-(4-ethoxyanilino)ethylidene]cyclohexa-2,4-dien-1-one, (6Z)-4-chloro-6-[1-(4-ethoxyanilino)ethylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C16H16ClNO2 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.08694 |
| Heavy Atoms | 20 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 105533-42-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N=C(C)C2=C(C=CC(=C2)Cl)O |
| InChIKey | AJVPBYOILTWDIC-UHFFFAOYSA-N |
Product Overview
Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- (CAS 105533-42-4), with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol. IUPAC: 4-chloro-2-[N-(4-ethoxyphenyl)-C-methylcarbonimidoyl]phenol.
Chemical Property Profile of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-
Property Insights of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-
The XLogP value of 4.1 indicates that Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.8 Ų, Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- has 1 hydrogen bond donor(s) and 3 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 Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-?
The CAS number of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- is 105533-42-4.
What is the molecular formula of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-?
The molecular formula of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- is C16H16ClNO2.
What is the molecular weight of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-?
The molecular weight of Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- is 289.09 g/mol.
Where can I buy Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-?
You can request a quote for Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-chloro-2-[1-[(4-ethoxyphenyl)imino]ethyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.