104303-72-2
3,5-DIHYDRO-7-(HYDROXYMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
Name3,5-DIHYDRO-7-(HYDROXYMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
1Identification
【Name】
3,5-DIHYDRO-7-(HYDROXYMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD00619255
【English Synonyms】
【Formula】
C7 H7 N3 O2
【MolWeight】
165.151
【Inchi】
InChI=1S/C7H7N3O2/c11-2-4-1-8-6-5(4)9-3-10-7(6)12/h1,3,8,11H,2H2,(H,9,10,12)
【InChIKey】
InChIKey=ZITWYICXCGENBW-UHFFFAOYSA-N
【SMILES】
c1c(c2c([nH]1)c(=O)[nH]cn2)CO
【MOL File】
3,5-DIHYDRO-7-(HYDRO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DIHYDRO-7-(HYDROXYMETHYL)-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE.cml