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3-Allyl-2-Mercaptothieno[2,3-d]Pyrimidin-4(3H)-One
[CAS# 51550-04-0]

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Identification
Name 3-Allyl-2-Mercaptothieno[2,3-d]Pyrimidin-4(3H)-One
Synonyms 3-Allyl-2-Thioxo-1H-Thieno[3,2-E]Pyrimidin-4-One; Mls001018194; Smr000354452
Molecular Structure CAS#: 51550-04-0, 3-Allyl-2-Mercaptothieno[2,3-d]Pyrimidin-4(3H)-One
Molecular Formula C9H8N2OS2
Molecular Weight 224.30
CAS Registry Number 51550-04-0
SMILES C1=CSC2=C1C(=O)N(C(=S)N2)CC=C
InChI 1S/C9H8N2OS2/c1-2-4-11-8(12)6-3-5-14-7(6)10-9(11)13/h2-3,5H,1,4H2,(H,10,13)
InChIKey CBGGZFBMKNURDF-UHFFFAOYSA-N
Properties
Density 1.447g/cm3 (Cal.)
Boiling point 362.578°C at 760 mmHg (Cal.)
Flash point 173.081°C (Cal.)
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