4-[[3-[2-[2-[4-[(4-Chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid

Base Information

• Chemical Name: 4-[[3-[2-[2-[4-[(4-Chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid
• CAS No.: 5978-92-7
• Molecular Formula: C44H41 Cl N2 O7
• Molecular Weight: 745.32
• DSSTox Substance ID: DTXSID70975195
• Nikkaji Number: J34.620I
• Mol file: 5978-92-7.mol

Synonyms:Hydroxyzine pamoate (ester);5978-92-7;4-[[3-[2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid;2-Naphthoic acid, 4,4'-methylenebis(3-hydroxy-, ester with 2-(2-(4-(p-chloro-alpha-phenylbenzyl)-1-piperazinyl)-ethoxy)ethanol;C44H41ClN2O7;DTXSID70975195;C44-H41-Cl-N2-O7;LS-95383;2-Naphthalenecarboxylic acid, 4-[(3-carboxy-2-hydroxy-1-naphthalenyl)methyl]-3-hydroxy-, 2-[2-[2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]ethyl] ester;2-Naphthoic acid, 4,4'-methylenebis[3-hydroxy-, ester with 2-[2-[4-(p-chloro-.alpha.-phenylbenzyl)-1-piperazinyl]ethoxy]ethanol;4-[(3-{[2-(2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)ethoxy]carbonyl}-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;4-[[3-[2-[2-[4-[(4-Chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]ethoxycarbonyl]-2-hydroxy-1-naphthalenyl]methyl]-3-hydroxy-2-naphthalenecarboxylic acid

Chemical Property of 4-[[3-[2-[2-[4-[(4-Chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 3E-30mmHg at 25°C
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 843.8°C at 760 mmHg
• Flash Point: 464.1°C
• PSA: 119.77000
• Density: 1.333g/cm³
• LogP: 7.80300
• XLogP3: 7.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 14
• Exact Mass: 744.2602293
• Heavy Atom Count: 54
• Complexity: 1190

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CCOCCOC(=O)C2=CC3=CC=CC=C3C(=C2O)CC4=C(C(=CC5=CC=CC=C54)C(=O)O)O)C(C6=CC=CC=C6)C7=CC=C(C=C7)Cl