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ScientificNameLabel
Thuj-3-en-10-al
PHCD compound ID : 1432
Chemical Names :
Thuj-3-en-10-al
Molecular Formula : C10H14O1
Molecular Weight : 150.104465
More Details :
Names & Synonyms: 1-isopropylbicyclo[3.1.0]hex-2-ene-4-carbaldehyde , 1-propan-2-yl-4-bicyclo[3.1.0]hex-2-enecarboxaldehyde , 1-propan-2-ylbicyclo[3.1.0]hex-2-ene-4-carbaldehyde
Smiles: O=C[C@H]1C=C[C@]2([C@@H]1C2)C(C)C
InChi : InChI=1S/C10H14O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h3-4,6-9H,5H2,1-2H3/t8-,9-,10-/m1/s1
InChi Key : InChIKey=UQLNHDYBGCTZNJ-OPRDCNLKSA-N
PubChem ID : 6429043
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.692831
Hydrogen bond donor count : 0 Electric dipole moment : 2.661
XLogP : 2.864 VDW volume : 160.320697
Molecular weight : 150.104465 HOMO-LUMO gap : 10.243000
Herb list :
Refrences & Litretures:
  
154.      Journal:'Flavour Fragr. J'      Year:'1997'      Volume:'12'      Page:'71'      DOI:''      Title:'Constituents of the Essential Oil of Achillea eriophora DC'
158.      Journal:'JOURNAL OF BIOSCIENCE AND BIOENGINEERING'      Year:'2008'      Volume:'105'      Page:'176'      DOI:'10.1263/jbb.105.176'      Title:'Mass Propagation and Essential Oil Analysis of Artemisia vulgaris'
180.      Journal:'Journal of Essential Oil Research'      Year:'1999'      Volume:'11'      Page:'306'      DOI:'10.1080/10412905.1999.9701140'      Title:'Aromatic Plants of Yugoslavia. I. Chemical Composition of Oils of Achillea millefolium L. ssp. pannonica (Scheele) Hayak, A. crithmifolia W. et K., A. serbica Nym. and A. tanacetifolia All'
605.      Journal:'J Sci Food Agric'      Year:'2013'      Volume:'93'      Page:'2494'      DOI:'10.1002/jsfa.6065'      Title:'Chemical constituents and anti-ulcerogenic potential of the scales of Cynara scolymus (artichoke) heads'
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