27277-00-5

Name 2-Amino-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
CAS 27277-00-5
EINECS(EC#) 248-383-5
Molecular Formula C9H13N5O
MDL Number MFCD06407961
Molecular Weight 207.23
MOL File 27277-00-5.mol

Chemical Properties

Melting point  161.8-163 °C
Boiling point  459.9±28.0 °C(Predicted)
density  1.44±0.1 g/cm3(Predicted)
vapor pressure  0.004Pa at 25℃
storage temp.  2-8°C
solubility  DMSO: 13 mg/mL
form  solid
pka 2.96±0.40(Predicted)
color  white
Water Solubility  5.7g/L at 20℃
InChI 1S/C9H13N5O/c1-3-4-13-7(15)6(2)5-14-9(13)11-8(10)12-14/h5H,3-4H2,1-2H3,(H2,10,12)
InChIKey UQDVRVNMIJAGRK-UHFFFAOYSA-N
SMILES CCCN1C(=O)C(C)=Cn2nc(N)nc12
LogP 0.49 at 20℃
CAS DataBase Reference 27277-00-5(CAS DataBase Reference)
EPA Substance Registry System 27277-00-5(EPA Substance)

Safety Data

RIDADR  2811
WGK Germany  1
TSCA  TSCA listed
REACH Registrations Active
HazardClass  6.1(b)
PackingGroup  III
Storage Class 11 - Combustible Solids

Hazard Information

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