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Home >> Chemical Listing >> Page 649 >> 6-Amino-2-[(2-Methylbenzyl)Sulfanyl]-4(1H)-Pyrimidinone

6-Amino-2-[(2-Methylbenzyl)Sulfanyl]-4(1H)-Pyrimidinone
[CAS# 166751-33-3]

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Identification
Name 6-Amino-2-[(2-Methylbenzyl)Sulfanyl]-4(1H)-Pyrimidinone
Synonyms 4(1H)-PYRIMIDINONE, 6-AMINO-2-[[(2-METHYLPHENYL)METHYL]THIO]-; 6-amino-2-[(2-methylbenzyl)thio]-4(3H)-pyrimidinone
Molecular Structure CAS#: 166751-33-3, 6-Amino-2-[(2-Methylbenzyl)Sulfanyl]-4(1H)-Pyrimidinone
Molecular Formula C12H13N3OS
Molecular Weight 247.32
CAS Registry Number 166751-33-3
SMILES O=C/2/N=C(/SCc1ccccc1C)NC(\N)=C\2
InChI 1S/C12H13N3OS/c1-8-4-2-3-5-9(8)7-17-12-14-10(13)6-11(16)15-12/h2-6H,7H2,1H3,(H3,13,14,15,16)
InChIKey JCGSUAADGPAKEI-UHFFFAOYSA-N
Properties
Density 1.33g/cm3 (Cal.)
Boiling point 410.045°C at 760 mmHg (Cal.)
Flash point 201.788°C (Cal.)
Refractive index 1.667 (Cal.)
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