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ScientificNameLabel
6-Methyl coumarin
PHCD compound ID : 4583
Chemical Names :
6-Methyl coumarin
Molecular Formula : C10H8O2
Molecular Weight : 160.052429
More Details :
Names & Synonyms: 6-methylchromen-2-one , 6-methyl-1-benzopyran-2-one , 6-methylcoumarin
Smiles: Cc1ccc2c(c1)ccc(=O)o2
InChi : InChI=1S/C10H8O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h2-6H,1H3
InChi Key : InChIKey=FXFYOPQLGGEACP-UHFFFAOYSA-N
PubChem ID : 7092
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.302587
Hydrogen bond donor count : 0 Electric dipole moment : 5.276
XLogP : 1.414 VDW volume : 150.301547
Molecular weight : 160.052429 HOMO-LUMO gap : 8.171000
Herb list :
Refrences & Litretures:
  
704.      Journal:'Journal of Biologically Active Products from Nature'      Year:'2015'      Volume:'5'      Page:'1'      DOI:''      Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil of Eugenia caryophyllata Cloves Extracted by Conventional and Microwave Techniques'
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