Identification Chemical Properties Safety Data Hazard Information Supplier Related Products

155405-80-4

Name 4-[2-(2-Amino-4,7-dihydro-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid methyl ester
CAS 155405-80-4
EINECS(EC#) 1806241-263-5
Molecular Formula C16H16N4O3
MDL Number MFCD17976681
Molecular Weight 312.32
MOL File 155405-80-4.mol

Chemical Properties

Melting point  >220 °C
density  1.44
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  DMSO (Slightly), Methanol (Very Slightly, Heated)
form  Solid
pka 11.21±0.20(Predicted)
color  Off-White to Pale Beige
InChI InChI=1S/C16H16N4O3/c1-23-15(22)10-5-2-9(3-6-10)4-7-11-8-18-13-12(11)14(21)20-16(17)19-13/h2-3,5-6,8H,4,7H2,1H3,(H4,17,18,19,20,21)
InChIKey GDEKSBCRJKAARB-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=CC=C(CCC2C3C(=O)NC(N)=NC=3NC=2)C=C1

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
HS Code  2933.99.8290

Hazard Information

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