4658-28-0

Name AZIPROTRYNE
CAS 4658-28-0
EINECS(EC#) 225-101-9
Molecular Formula C7H12N7S+
MDL Number MFCD00078637
Molecular Weight 226.28
MOL File 4658-28-0.mol
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Chemical Properties

Melting point  95°C
density  1.2855 (rough estimate)
refractive index  1.6000 (estimate)
Fp  >100 °C
storage temp.  -20°C Freezer
solubility  DMSO (Slightly), Methanol (Very Slightly)
form  Solid
color  Crystals or powder
Water Solubility  55mg/L(20 ºC)
Henry's Law Constant 4.0×102 mol/(m3Pa) at 25℃, Abraham et al. (2007)
Major Application agriculture
environmental
InChI 1S/C7H11N7S/c1-4(2)9-5-10-6(13-14-8)12-7(11-5)15-3/h4H,1-3H3,(H,9,10,11,12)
InChIKey AFIIBUOYKYSPKB-UHFFFAOYSA-N
SMILES CSc1nc(NC(C)C)nc(N=[N+]=[N-])n1
EPA Substance Registry System Aziprotryne (4658-28-0)

Safety Data

WGK Germany  WGK 3
RTECS  XY3280000
Storage Class 11 - Combustible Solids
Toxicity
LD50 orl-rat: 3600 mg/kg FMCHA2 -,C150,830

Hazard Information

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