Melting point |
163-164°C |
Boiling point |
562.7±60.0 °C(Predicted) |
Density |
1.5111 (rough estimate) |
refractive index |
1.7400 (estimate) |
storage temp. |
2-8°C |
solubility |
Very slightly soluble in water, freely soluble in glacial acetic acid, very slightly soluble in anhydrous ethanol, practically insoluble in ethyl acetate. It dissolves in dilute mineral acids |
pka |
pKa 6.76(H2O t=23.0) (Uncertain) |
form |
Solid |
color |
White to Off-White |
Water Solubility |
1.1 mg/mL |
BCS Class |
3 |
Stability |
Light Sensitive |
InChI |
InChI=1S/C8H15N7O2S3/c9-6(15-20(12,16)17)1-2-18-3-5-4-19-8(13-5)14-7(10)11/h4H,1-3H2,(H2,9,15)(H2,12,16,17)(H4,10,11,13,14) |
InChIKey |
XUFQPHANEAPEMJ-UHFFFAOYSA-N |
SMILES |
C(NS(N)(=O)=O)(=N)CCSCC1=CSC(NC(N)=N)=N1 |
CAS DataBase Reference |
76824-35-6(CAS DataBase Reference) |
EPA Substance Registry System |
Propanimidamide, 3-[[[2-[(aminoiminomethyl)amino]-4-thiazolyl]methyl]thio]-N-(aminosulfonyl)- (76824-35-6) |