Statements (23)
Predicate | Object |
---|---|
gptkbp:instanceOf |
ketone
|
gptkbp:appearance |
colorless liquid
|
gptkbp:aroma |
sweet, acetone-like
|
gptkbp:boilingPoint |
102 °C
|
gptkbp:CASNumber |
96-22-0
|
gptkbp:chemicalFormula |
C5H10O
|
gptkbp:density |
0.809 g/cm³
|
gptkbp:hasInChIKey |
InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3
YYHKZZFFCNAPFJ-UHFFFAOYSA-N |
gptkbp:hasSMILES |
CCC(=O)CC
|
https://www.w3.org/2000/01/rdf-schema#label |
3-pentanone
|
gptkbp:IUPACName |
pentan-3-one
|
gptkbp:meltingPoint |
-48 °C
|
gptkbp:molecularWeight |
86.13 g/mol
|
gptkbp:PubChem_CID |
7991
|
gptkbp:riskFactor |
flammable
|
gptkbp:solubility |
moderate
|
gptkbp:structure |
CH3CH2COCH2CH3
|
gptkbp:UNNumber |
1090
|
gptkbp:uses |
solvent
intermediate in organic synthesis |
gptkbp:bfsParent |
gptkb:2-butanone
|
gptkbp:bfsLayer |
7
|