2-Isopropyl-5-(3-(2-methoxyphenoxy)propylamino)-2-(3,4,5-trimethoxyphenyl)valeronitrile fumarate

Base Information

• Chemical Name: 2-Isopropyl-5-(3-(2-methoxyphenoxy)propylamino)-2-(3,4,5-trimethoxyphenyl)valeronitrile fumarate
• CAS No.: 103545-91-1
• Molecular Formula: C31H42N2O9
• Molecular Weight: 586.67318
• Mol file: 103545-91-1.mol

Synonyms:2-isopropyl-5-(3-(2-methoxyphenoxy)propylamino)-2-(3,4,5-trimethoxyphenyl)valeronitrile fumarate;HV 525;HV-525

Chemical Property of 2-Isopropyl-5-(3-(2-methoxyphenoxy)propylamino)-2-(3,4,5-trimethoxyphenyl)valeronitrile fumarate

Chemical Property:

• Vapor Pressure: 6.79E-15mmHg at 25°C
• Boiling Point: 611.5°Cat760mmHg
• Flash Point: 323.6°C
• PSA: 156.57000
• Density: g/cm³
• LogP: 5.07998
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 17
• Exact Mass: 586.28903092
• Heavy Atom Count: 42
• Complexity: 714

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(CCCNCCCOC1=CC=CC=C1OC)(C#N)C2=CC(=C(C(=C2)OC)OC)OC.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC(C)C(CCCNCCCOC1=CC=CC=C1OC)(C#N)C2=CC(=C(C(=C2)OC)OC)OC.C(=C/C(=O)O)\C(=O)O

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