2,4,6-Pyrimidinetriamine, 5-(4-phenylbutyl)-

Base Information

• Chemical Name: 2,4,6-Pyrimidinetriamine, 5-(4-phenylbutyl)-
• CAS No.: 1597-00-8
• Molecular Formula: C14H19 N5
• Molecular Weight: 257.3342
• NSC Number: 89818
• UNII: 6LJ97GCD83
• DSSTox Substance ID: DTXSID60166712
• Wikidata: Q83035938
• ChEMBL ID: CHEMBL1520603
• Mol file: 1597-00-8.mol

Synonyms:1597-00-8;2,4,6-Pyrimidinetriamine, 5-(4-phenylbutyl)-;NSC89818;6LJ97GCD83;NSC 89818;NSC-89818;UNII-6LJ97GCD83;2,4,6-Triamino-5-(4-phenylbutyl)pyrimidine;5-(4-phenylbutyl)-2,4,6-pyrimidinetriamine;5-(4-phenylbutyl)pyrimidine-2,4,6-triamine;NCIStruc1_000885;NCIStruc2_000516;CHEMBL1520603;DTXSID60166712;NCI89818;CCG-36683;NCGC00013941;NCGC00013941-02;NCGC00097050-01;NCI60_041994;PYRIMIDINE, 2,4,6-TRIAMINO-5-(4-PHENYLBUTYL)-

Chemical Property of 2,4,6-Pyrimidinetriamine, 5-(4-phenylbutyl)-

Chemical Property:

• Vapor Pressure: 3.35E-12mmHg at 25°C
• Boiling Point: 551.3°C at 760 mmHg
• Flash Point: 321.3°C
• Density: 1.229g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 257.16404563
• Heavy Atom Count: 19
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCCCC2=C(N=C(N=C2N)N)N

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