129872-85-1
2-CHLORO-5-ETHYL-3,5-DIHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
Name2-CHLORO-5-ETHYL-3,5-DIHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
1Identification
【Name】
2-CHLORO-5-ETHYL-3,5-DIHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD17013909
【English Synonyms】
【Formula】
C8 H8 Cl N3 O
【MolWeight】
197.624
【Inchi】
InChI=1S/C8H8ClN3O/c1-2-12-4-3-5-6(12)7(13)11-8(9)10-5/h3-4H,2H2,1H3,(H,10,11,13)
【InChIKey】
InChIKey=DNRBPQVAJGNGEM-UHFFFAOYSA-N
【SMILES】
CCn1ccc2c1c(=O)[nH]c(n2)Cl
【MOL File】
2-CHLORO-5-ETHYL-3,5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-5-ETHYL-3,5-DIHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE.cml