1-Pyrrolidinevaleronitrile, alpha-1-naphthyl-

Base Information

• Chemical Name: 1-Pyrrolidinevaleronitrile, alpha-1-naphthyl-
• CAS No.: 13326-33-5
• Molecular Formula: C19H22N2
• Molecular Weight: 278.39
• DSSTox Substance ID: DTXSID90928022
• Nikkaji Number: J85.512J
• Mol file: 13326-33-5.mol

Synonyms:1-Pyrrolidinevaleronitrile, alpha-1-naphthyl-;13326-33-5;alpha-(3-Pyrrolidinopropyl)-1-naphthaleneacetonitrile;1-NAPHTHALENEACETONITRILE, alpha-(3-PYRROLIDINOPROPYL)-;2-(naphthalen-1-yl)-5-(pyrrolidin-1-yl)pentanenitrile;DTXSID90928022;LS-94427;1-Pyrrolidinevaleronitrile, .alpha.-1-naphthyl-;alpha-[3-(1-Pyrrolidinyl)propyl]-1-naphthaleneacetonitrile

Chemical Property of 1-Pyrrolidinevaleronitrile, alpha-1-naphthyl-

Chemical Property:

• Vapor Pressure: 5.82E-09mmHg at 25°C
• Boiling Point: 468.8°C at 760 mmHg
• PKA: 10.33±0.20(Predicted)
• Flash Point: 205°C
• PSA: 27.03000
• Density: 1.088g/cm³
• LogP: 4.26088
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 278.178298710
• Heavy Atom Count: 21
• Complexity: 363

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)CCCC(C#N)C2=CC=CC3=CC=CC=C32