871024-59-8
ETHYL (4-CHLORO-5H-PYRROLO[3,2-D]PYRIMIDIN-5-YL)ACETATE
NameETHYL (4-CHLORO-5H-PYRROLO[3,2-D]PYRIMIDIN-5-YL)ACETATE
1Identification
【Name】
ETHYL (4-CHLORO-5H-PYRROLO[3,2-D]PYRIMIDIN-5-YL)ACETATE
【CAS】
【MDL】
MFCD17012998
【English Synonyms】
【Formula】
C10 H10 Cl N3 O2
【MolWeight】
239.661
【Inchi】
InChI=1S/C10H10ClN3O2/c1-2-16-8(15)5-14-4-3-7-9(14)10(11)13-6-12-7/h3-4,6H,2,5H2,1H3
【InChIKey】
InChIKey=CNCJJFYXDDFPBX-UHFFFAOYSA-N
【SMILES】
CCOC(=O)Cn1ccc2c1c(ncn2)Cl
【MOL File】
ETHYL (4-CHLORO-5H-P….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL (4-CHLORO-5H-PYRROLO[3,2-D]PYRIMIDIN-5-YL)ACETATE.cml