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(2E)-3-[2-(Methylsulfanyl)-5-pyrimidinyl]acrylic acid
[CAS# 915924-30-0]

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Identification
Name (2E)-3-[2-(Methylsulfanyl)-5-pyrimidinyl]acrylic acid
Synonyms (2E)-3-[2-(methylthio)pyrimidin-5-yl]acrylic acid; MFCD08691534
Molecular Structure CAS#: 915924-30-0, (2E)-3-[2-(Methylsulfanyl)-5-pyrimidinyl]acrylic acid
Molecular Formula C8H8N2O2S
Molecular Weight 196.23
CAS Registry Number 915924-30-0
SMILES CSc1ncc(cn1)C=CC(=O)O
InChI 1S/C8H8N2O2S/c1-13-8-9-4-6(5-10-8)2-3-7(11)12/h2-5H,1H3,(H,11,12)/b3-2+
InChIKey WPRBLLNMSHVARX-NSCUHMNNSA-N
Properties
Density 1.37g/cm3 (Cal.)
Boiling point 398.082°C at 760 mmHg (Cal.)
Flash point 194.553°C (Cal.)
Refractive index 1.621 (Cal.)
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