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2H-Pyrimido[2,1-c][1,2,4]Triazine-4-Thiol
[CAS# 130314-21-5]

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Identification
Name 2H-Pyrimido[2,1-c][1,2,4]Triazine-4-Thiol
Synonyms 2-(dihydroxymethyl)-2,5-dihydrofuran-2,5-diol
Molecular Structure CAS#: 130314-21-5, 2H-Pyrimido[2,1-c][1,2,4]Triazine-4-Thiol
Molecular Formula C6H6N4S
Molecular Weight 166.20
CAS Registry Number 130314-21-5
SMILES C1=CN2C(=CNN=C2N=C1)S
InChI 1S/C6H6N4S/c11-5-4-8-9-6-7-2-1-3-10(5)6/h1-4,8,11H
InChIKey ZUESFEFDQHZFBP-UHFFFAOYSA-N
Properties
Density 1.574g/cm3 (Cal.)
Boiling point 287.026°C at 760 mmHg (Cal.)
Flash point 127.389°C (Cal.)
Refractive index 1.809 (Cal.)
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