Skip Navigation Links
ScientificNameLabel
2,5-Dimethylanisole
PHCD compound ID : 4599
Chemical Names :
2,5-Dimethylanisole
Molecular Formula : C9H12O1
Molecular Weight : 136.088815
More Details :
Names & Synonyms: 2-methoxy-1,4-dimethyl-benzene , 2-methoxy-1,4-dimethylbenzene
Smiles: COc1cc(C)ccc1C
InChi : InChI=1S/C9H12O/c1-7-4-5-8(2)9(6-7)10-3/h4-6H,1-3H3
InChi Key : InChIKey=SJZAUIVYZWPNAS-UHFFFAOYSA-N
PubChem ID : 74350
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.630128
Hydrogen bond donor count : 0 Electric dipole moment : 1.536
XLogP : 1.84 VDW volume : 141.844712
Molecular weight : 136.088815 HOMO-LUMO gap : 9.040000
Herb list :
Refrences & Litretures:
  
711.      Journal:'Food Chemistry'      Year:'2001'      Volume:'74'      Page:'443'      DOI:''      Title:'Antioxidant property of aroma extract isolated from clove buds [Syzygium aromaticum (L.) Merr. et Perry]'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us