436088-51-6
[2-(2,5-DIOXO-HEXAHYDRO-IMIDAZO[4,5-D]IMIDAZOL-1-YL)-ACETYLAMINO]-ACETIC ACID
Name[2-(2,5-DIOXO-HEXAHYDRO-IMIDAZO[4,5-D]IMIDAZOL-1-YL)-ACETYLAMINO]-ACETIC ACID
1Identification
【Name】
[2-(2,5-DIOXO-HEXAHYDRO-IMIDAZO[4,5-D]IMIDAZOL-1-YL)-ACETYLAMINO]-ACETIC ACID
【CAS】
【MDL】
MFCD01972892
【English Synonyms】
【Formula】
C8 H11 N5 O5
【MolWeight】
257.205
【Inchi】
InChI=1S/C8H11N5O5/c14-3(9-1-4(15)16)2-13-6-5(11-8(13)18)10-7(17)12-6/h5-6H,1-2H2,(H,9,14)(H,11,18)(H,15,16)(H2,10,12,17)
【InChIKey】
InChIKey=CXCKOTGRTPLISC-UHFFFAOYSA-N
【SMILES】
C(C(=O)O)NC(=O)CN1C2C(NC(=O)N2)NC1=O
【MOL File】
[2-(2,5-DIOXO-HEXAHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:10
XLogP3:-4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[2-(2,5-DIOXO-HEXAHYDRO-IMIDAZO[4,5-D]IMIDAZOL-1-YL)-ACETYLAMINO]-ACETIC ACID.cml