HIT ID: HIT212089021
Cas No: 1604-28-0
分子式: C8H12O
分子量: 124.183
常用名: 6-methyl-3,5-heptadien-2-one
氢键受体数 (HBA): 1
氢键供体数 (HBD): 0
LogP: 2.0197847
IUPAC: 6-methylhepta-3,5-dien-2-one
IUPAC: 6-methylhepta-3,5-dien-2-one
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-[#6](-[#6])=O |w:4.3|
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-[#6](-[#6])=O |w:4.3|
InChI key: KSKXSFZGARKWOW-UHFFFAOYSA-N