51933-01-8
2-AMINO-1,9-DIHYDRO-9-HYDROXY-6H-PURIN-6-ONE
Name2-AMINO-1,9-DIHYDRO-9-HYDROXY-6H-PURIN-6-ONE
1Identification
【Name】
2-AMINO-1,9-DIHYDRO-9-HYDROXY-6H-PURIN-6-ONE
【CAS】
【MDL】
MFCD20698361
【English Synonyms】
【Formula】
C5 H5 N5 O2
【MolWeight】
167.128
【Inchi】
InChI=1S/C5H5N5O2/c6-5-8-3-2(4(11)9-5)7-1-10(3)12/h1,12H,(H3,6,8,9,11)
【InChIKey】
InChIKey=POKKKXYWJJCVCY-UHFFFAOYSA-N
【SMILES】
c1nc2c(=O)[nH]c(nc2n1O)N
【MOL File】
2-AMINO-1,9-DIHYDRO-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:7
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-AMINO-1,9-DIHYDRO-9-HYDROXY-6H-PURIN-6-ONE.cml