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4,4,6-Trimethyl-1-(3-Methylphenyl)-3H-Pyrimidine-2-Thione
[CAS# 37489-45-5]

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Identification
Name 4,4,6-Trimethyl-1-(3-Methylphenyl)-3H-Pyrimidine-2-Thione
Synonyms Nsc49824; Usaf K-1341; 4,4,6-Trimethyl-1-M-Tolyl-3,4-Dihydro-1H-Pyrimidine-2-Thione
Molecular Structure CAS#: 37489-45-5, 4,4,6-Trimethyl-1-(3-Methylphenyl)-3H-Pyrimidine-2-Thione
Molecular Formula C14H18N2S
Molecular Weight 246.37
CAS Registry Number 37489-45-5
SMILES C1=CC=C(C)C=C1N2C(NC(C=C2C)(C)C)=S
InChI 1S/C14H18N2S/c1-10-6-5-7-12(8-10)16-11(2)9-14(3,4)15-13(16)17/h5-9H,1-4H3,(H,15,17)
InChIKey POYSSAUIZAGEPU-UHFFFAOYSA-N
Properties
Density 1.144g/cm3 (Cal.)
Boiling point 345.584°C at 760 mmHg (Cal.)
Flash point 162.804°C (Cal.)
References
(1) Aamer Saeed, Rasheed Ahmad Khera and Masood Parvez . 4,4,6-Trimethyl-1-(3-methylphenyl)-3,4-dihydropyrimidine-2(1H)-thione , Acta Cryst (2010). E66, o635  
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