887595-34-8
1-[3-AMINO-4-(4-METHYL-4H-PYRAZIN-1-YL)-PHENYL]-ETHANONE
Name1-[3-AMINO-4-(4-METHYL-4H-PYRAZIN-1-YL)-PHENYL]-ETHANONE
1Identification
【Name】
1-[3-AMINO-4-(4-METHYL-4H-PYRAZIN-1-YL)-PHENYL]-ETHANONE
【CAS】
【MDL】
MFCD07787197
【English Synonyms】
【Formula】
C13 H15 N3 O
【MolWeight】
229.281
【Inchi】
InChI=1S/C13H15N3O/c1-10(17)11-3-4-13(12(14)9-11)16-7-5-15(2)6-8-16/h3-9H,14H2,1-2H3
【InChIKey】
InChIKey=URHNUOKSSUHOOR-UHFFFAOYSA-N
【SMILES】
CC(=O)c1ccc(c(c1)N)N2C=CN(C=C2)C
【MOL File】
1-[3-AMINO-4-(4-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[3-AMINO-4-(4-METHYL-4H-PYRAZIN-1-YL)-PHENYL]-ETHANONE.cml