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Compound: 5546
Plants: 312
References: 992
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acetaldehyde
ScientificNameLabel
acetaldehyde
PHCD compound ID :
2103
Chemical Names :
acetaldehyde
Molecular Formula :
C2H4O1
Molecular Weight :
44.026215
More Details :
Names & Synonyms:
acetaldehyde , ethanal
Smiles:
CC=O
InChi :
InChI=1S/C2H4O/c1-2-3/h2H,1H3
InChi Key :
InChIKey=IKHGUXGNUITLKF-UHFFFAOYSA-N
PubChem ID :
177
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
10.296891
Hydrogen bond donor count :
0
Electric dipole moment :
3.078
XLogP :
0.334
VDW volume :
49.302196
Molecular weight :
44.026215
HOMO-LUMO gap :
10.976000
Herb list :
Alfalfa, Lucerne - Medicago sativa - یونجه
Clary, Clary sage - Salvia sclarea - مریم گلی
Damask rose, Persian rose - Rosa damascena - گل محمدی، گل گلاب
Hazel, Filbert - Corylus avellana - فندق
Strawberry - Fragaria vesca - توت فرنگی
Tamarind, Indian date - Tamarindus indica - تمرهندی
Refrences & Litretures:
251. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'318' DOI:'10.1080/10412905.2004.9698731' Title:'Volatile Components of Tamarind (Tamarindus indica L.) Grown in Cuba'
262. Journal:'J Sci Food Agric' Year:'1997' Volume:'74' Page:'421' DOI:'' Title:'Strawberry Flavour: Analysis and Biosynthesis'
552. Journal:'Radiation Physics and Chemistry' Year:'2009' Volume:'78' Page:'407' DOI:'10.1016/j.radphyschem.2009.03.008' Title:'Effect of ?-irradiation on the physicochemical and sensory properties of hazelnuts (Corylus avellana L.)'
635. Journal:'Analytica Chimica Acta' Year:'2006' Volume:'566' Page:'172' DOI:'10.1016/j.aca.2006.03.014' Title:'Comparison of direct thermal desorption with water distillation and superheated water extraction for the analysis of volatile components of Rosa damascena Mill. using GCxGC-TOF/MS'
749. Journal:'J. Agric. food Chem' Year:'1983' Volume:'31' Page:'38' DOI:'10.1021/jf00115a010' Title:'Composition of the Essential Oil of Alfalfa'
776. Journal:'International Journal of Agriculture and Crop Sciences' Year:'2013' Volume:'5' Page:'828' DOI:'' Title:'Comparison of Salvia sclarea L. Essential Oil Components in Wild and Field Population'
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