892502-00-0
ETHYL 5,6,7,8-TETRAHYDROIMIDAZO[1,2-A]PYRAZINE-2-CARBOXYLATE DIHYDROCHLORIDE HEMIHYDRATE
NameETHYL 5,6,7,8-TETRAHYDROIMIDAZO[1,2-A]PYRAZINE-2-CARBOXYLATE DIHYDROCHLORIDE HEMIHYDRATE
FormulaC9 H13 N3 O2 . 2 Cl H . H2 O
1Identification
【Name】
ETHYL 5,6,7,8-TETRAHYDROIMIDAZO[1,2-A]PYRAZINE-2-CARBOXYLATE DIHYDROCHLORIDE HEMIHYDRATE
【CAS】
【MDL】
MFCD08690296
【English Synonyms】
【Formula】
C9 H13 N3 O2 . 2 Cl H . H2 O
【MolWeight】
286.157
【Inchi】
InChI=1S/C9H13N3O2.2ClH.H2O/c1-2-14-9(13)7-6-12-4-3-10-5-8(12)11-7;;;/h6,10H,2-5H2,1H3;2*1H;1H2
【InChIKey】
InChIKey=FVACSCIVHHZRPL-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cn2c(n1)CNCC2.O.Cl.Cl
【MOL File】
ETHYL 5,6,7,8-TETRAH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5,6,7,8-TETRAHYDROIMIDAZO[1,2-A]PYRAZINE-2-CARBOXYLATE DIHYDROCHLORIDE HEMIHYDRATE.cml