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Substance Name: DIC 1542
RN: 21087-60-5
InChIKey: CRXJGDFHBGGVNF-UHFFFAOYSA-N

Molecular Formula

  • C7-H12-N4-O-S

Molecular Weight

  • 200.265
 
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Names and Synonyms

Results Name

  • DIC 1542

Systematic Name

  • 1,2,4-Triazin-5(4H)-one, 4-amino-3-(methylthio)-6-propyl-

Registry Numbers

CAS Registry Number

  • 21087-60-5

System Generated Number

  • 0021087605

Structure Descriptors

InChI

1S/C7H12N4OS/c1-3-4-5-6(12)11(8)7(13-2)10-9-5/h3-4,8H2,1-2H3

InChIKey

CRXJGDFHBGGVNF-UHFFFAOYSA-N

Smiles

O=c1n(N)c(SC)nnc1CCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.93 (none)   EXP
Water Solubility 7010 mg/L 25 EST
Vapor Pressure 2.78E-06 mm Hg 25 EST
Henry's Law Constant 1.36E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.36E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.