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ScientificNameLabel
Pseudocumene
PHCD compound ID : 1023
Chemical Names :
1,2,4-Trimethylbenzene , 1,2,4-Trimethyl benzene , 1,2,4-trimethyIbenzene , Pseudocumene
Molecular Formula : C9H12
Molecular Weight : 120.0939
More Details :
Names & Synonyms: 1,2,4-trimethylbenzene , pseudocumene
Smiles: Cc1ccc(c(c1)C)C
InChi : InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3
InChi Key : InChIKey=GWHJZXXIDMPWGX-UHFFFAOYSA-N
PubChem ID : 7247
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.937774
Hydrogen bond donor count : 0 Electric dipole moment : 0.630
XLogP : 3.258 VDW volume : 133.054486
Molecular weight : 120.0939 HOMO-LUMO gap : 9.430000
Herb list :
Refrences & Litretures:
  
105.      Journal:'Natural Product Communications'      Year:'2009'      Volume:'4'      Page:'859'      DOI:''      Title:'Composition and Antibacterial Activity of Essential Oils from Leaf, Stem and Root of Chrysanthemum parthenium (L.) Bernh. from Iran'
145.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2012'      Volume:'15'      Page:'645'      DOI:'10.1080/0972060X.2012.10644099'      Title:'The Frist Research on The Essential Oil of Iranian Rice (Oryza sativa L.)'
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'
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'
290.      Journal:'Journal of Essential Oil Research'      Year:'1995'      Volume:'7'      Page:'425'      DOI:'10.1080/10412905.1995.9698554'      Title:'Volatile Components of Lawsonia inermis L. Flowers'
339.      Journal:'J. Agric. Food Chem'      Year:'1978'      Volume:'26'      Page:'1290'      DOI:'10.1021/jf60220a012'      Title:'Volatile components of corn silk (Zea mays L.): possible Heliothis zea (Boddie) attractants'
755.      Journal:'Experimental Parasitology'      Year:'2012'      Volume:'132'      Page:'470'      DOI:'org/10.1016/j.exppara.2012.09.010'      Title:'Identification of chemical constituents and larvicidal activity of Kelussia odoratissima Mozaffarian essential oil against two mosquito vectors Anopheles stephensi and Culex pipiens (Diptera: Culicidae)'
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