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Home >> Chemical Listing >> Page 2462 >> 4-Imino-1-methyl-1,4-dihydro-2-pyrimidinyl thiocyanate

4-Imino-1-methyl-1,4-dihydro-2-pyrimidinyl thiocyanate
[CAS# 745009-20-5]

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Identification
Name 4-Imino-1-methyl-1,4-dihydro-2-pyrimidinyl thiocyanate
Synonyms 1-methyl-2-thiocyanatopyrimidin-4(1H)-imine; THIOCYANIC ACID,1,4-DIHYDRO-4-IMINO-1-METHYL-2-PYRIMIDINYL ESTER
Molecular Structure CAS#: 745009-20-5, 4-Imino-1-methyl-1,4-dihydro-2-pyrimidinyl thiocyanate
Molecular Formula C6H6N4S
Molecular Weight 166.20
CAS Registry Number 745009-20-5
SMILES Cn1ccc(=N)nc1SC#N
InChI 1S/C6H6N4S/c1-10-3-2-5(8)9-6(10)11-4-7/h2-3,8H,1H3
InChIKey YAVGGKQKUINKBZ-UHFFFAOYSA-N
Properties
Density 1.349g/cm3 (Cal.)
Boiling point 258.293°C at 760 mmHg (Cal.)
Flash point 110.012°C (Cal.)
Refractive index 1.671 (Cal.)
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