6312-01-2
4,4-DIMETHYL-1-PYRIDIN-4-YL-PENTANE-1,3-DIONE
Name4,4-DIMETHYL-1-PYRIDIN-4-YL-PENTANE-1,3-DIONE
1Identification
【Name】
4,4-DIMETHYL-1-PYRIDIN-4-YL-PENTANE-1,3-DIONE
【CAS】
【MDL】
MFCD11185174
【English Synonyms】
【Formula】
C12 H15 N O2
【MolWeight】
205.255
【Inchi】
InChI=1S/C12H15NO2/c1-12(2,3)11(15)8-10(14)9-4-6-13-7-5-9/h4-7H,8H2,1-3H3
【InChIKey】
InChIKey=UDVGQWHYFLERJZ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)C(=O)CC(=O)c1ccncc1
【MOL File】
4,4-DIMETHYL-1-PYRID….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,4-DIMETHYL-1-PYRIDIN-4-YL-PENTANE-1,3-DIONE.cml