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Home >> Chemical Listing >> Page 1187 >> 6-(Methylsulfanyl)-4-Pyrimidinecarboxylic Acid

6-(Methylsulfanyl)-4-Pyrimidinecarboxylic Acid
[CAS# 301342-78-9]

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Identification
Name 6-(Methylsulfanyl)-4-Pyrimidinecarboxylic Acid
Synonyms 4-PYRIMIDINECARBOXYLICACID, 6-(METHYLTHIO)-; 6-(methylthio)pyrimidine-4-carboxylic acid
Molecular Structure CAS#: 301342-78-9, 6-(Methylsulfanyl)-4-Pyrimidinecarboxylic Acid
Molecular Formula C6H6N2O2S
Molecular Weight 170.19
CAS Registry Number 301342-78-9
SMILES O=C(O)c1ncnc(SC)c1
InChI 1S/C6H6N2O2S/c1-11-5-2-4(6(9)10)7-3-8-5/h2-3H,1H3,(H,9,10)
InChIKey OQPGYKSUPSFPMQ-UHFFFAOYSA-N
Properties
Density 1.454g/cm3 (Cal.)
Boiling point 376.585°C at 760 mmHg (Cal.)
Flash point 181.552°C (Cal.)
Refractive index 1.623 (Cal.)
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