Hexahydrocoumarin

ScientificNameLabel

Hexahydrocoumarin
PHCD compound ID :	3417
Chemical Names :	Hexahydrocoumarin
Molecular Formula :	C9H12O2
Molecular Weight :	152.08373

More Details :

Names & Synonyms:	3,4,5,6,7,8-hexahydrochromen-2-one , 3,4,5,6,7,8-hexahydro-1-benzopyran-2-one
Smiles:	O=C1CCC2=C(O1)CCCC2
InChi :	InChI=1S/C9H12O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H2
InChi Key :	InChIKey=ODFRBYOJLDRSKF-UHFFFAOYSA-N
PubChem ID :	69694

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	9.120976
Hydrogen bond donor count :	0	Electric dipole moment :	4.409
XLogP :	0.921	VDW volume :	151.814939
Molecular weight :	152.08373	HOMO-LUMO gap :	9.737000

Herb list :

Will fumitory - Fumaria parviflora - شاه تره گل ریز

Refrences & Litretures:


476. Journal:'J. Pharm. BioSci' Year:'2014' Volume:'1' Page:'1' DOI:'' Title:'Phytochemical investigation of the aerial parts of Fumaria parviflora Lam'

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