67604-85-7
(2,2-DIMETHYL-6-PURIN-9-YL-TETRAHYDRO-FURO[3,4-D][1,3]DIOXOL-4-YL)-METHANOL
Name(2,2-DIMETHYL-6-PURIN-9-YL-TETRAHYDRO-FURO[3,4-D][1,3]DIOXOL-4-YL)-METHANOL
1Identification
【Name】
(2,2-DIMETHYL-6-PURIN-9-YL-TETRAHYDRO-FURO[3,4-D][1,3]DIOXOL-4-YL)-METHANOL
【CAS】
【MDL】
MFCD15833021
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13H16N4O4
【pro_molWeight】
292.293
【Inchi】
InChI=1S/C13H16N4O4/c1-13(2)20-9-8(4-18)19-12(10(9)21-13)17-6-16-7-3-14-5-15-11(7)17/h3,5-6,8-10,12,18H,4H2,1-2H3
【InChIKey】
InChIKey=PNOJPFMKVUJUIH-UHFFFAOYSA-N
【SMILES】
CC1(OC2C(O1)C(OC2CO)N2C1=NC=NC=C1N=C2)C
【MOL File】
(2,2-DIMETHYL-6-PURI….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:8
XLogP3:0.4679
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(2,2-DIMETHYL-6-PURIN-9-YL-TETRAHYDRO-FURO[3,4-D][1,3]DIOXOL-4-YL)-METHANOL.cml