6-Amino-2-{[3-(4-hydroxybutoxy)propyl]amino}-4-methylpyridine-3-carbonitrile

Base Information

• Chemical Name: 6-Amino-2-{[3-(4-hydroxybutoxy)propyl]amino}-4-methylpyridine-3-carbonitrile
• CAS No.: 52238-86-5
• Molecular Formula: C14H22N4O2
• Molecular Weight: 278.35
• European Community (EC) Number: 610-808-0
• DSSTox Substance ID: DTXSID40551768
• Nikkaji Number: J2.972.382F
• Wikidata: Q82431600
• Mol file: 52238-86-5.mol

Synonyms:52238-86-5;SCHEMBL16673306;DTXSID40551768;SGJCGUGJOUKDDB-UHFFFAOYSA-N;6-AMINO-2-{[3-(4-HYDROXYBUTOXY)PROPYL]AMINO}-4-METHYLPYRIDINE-3-CARBONITRILE

Chemical Property of 6-Amino-2-{[3-(4-hydroxybutoxy)propyl]amino}-4-methylpyridine-3-carbonitrile

Chemical Property:

• Vapor Pressure: 1.82E-12mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 539.4°C at 760 mmHg
• PKA: 15.07±0.10(Predicted)
• Flash Point: 280°C
• PSA: 104.92000
• Density: 1.16g/cm³
• LogP: 1.43808
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 278.17427596
• Heavy Atom Count: 20
• Complexity: 305

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=NC(=C1C#N)NCCCOCCCCO)N

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