Iso safrole(E)

ScientificNameLabel

Iso safrole(E)
PHCD compound ID :	1990
Chemical Names :	Iso safrole(E)
Molecular Formula :	C10H10O2
Molecular Weight :	162.06808

More Details :

Names & Synonyms:	5-[(E)-prop-1-enyl]-1,3-benzodioxole
Smiles:	C/C=C/c1ccc2c(c1)OCO2
InChi :	InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3/b3-2+
InChi Key :	InChIKey=VHVOLFRBFDOUSH-NSCUHMNNSA-N
PubChem ID :	637796

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	8.626640
Hydrogen bond donor count :	0	Electric dipole moment :	0.821
XLogP :	2.602	VDW volume :	152.938006
Molecular weight :	162.06808	HOMO-LUMO gap :	8.518000

Herb list :

Tarragon, Wild dragon - Artemisia dracunculus - ترخون

Refrences & Litretures:


238. Journal:'Jundishapur J Microbiol' Year:'2013' Volume:'6' Page:'e7877' DOI:'10.5812/jjm.7877' Title:'The Evaluation of the Antibacterial and Antioxidant Activity of Tarragon (Artemisia dracunculus L.) Essential Oil and Its Chemical Composition'

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