Tetrahydro-2-methyl-2H-pyran

ScientificNameLabel

Tetrahydro-2-methyl-2H-pyran
PHCD compound ID :	4512
Chemical Names :	Tetrahydro-2-methyl-2H-pyran
Molecular Formula :	C6H12O1
Molecular Weight :	100.088815

More Details :

Names & Synonyms:	2-methyltetrahydropyran , 2-methyloxane
Smiles:	C[C@@H]1CCCCO1
InChi :	InChI=1S/C6H12O/c1-6-4-2-3-5-7-6/h6H,2-5H2,1H3/t6-/m1/s1
InChi Key :	InChIKey=YBDQLHBVNXARAU-ZCFIWIBFSA-N
PubChem ID :	139099

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	9.649090
Hydrogen bond donor count :	0	Electric dipole moment :	1.497
XLogP :	1.344	VDW volume :	108.766134
Molecular weight :	100.088815	HOMO-LUMO gap :	12.319000

Herb list :

Lime - Citrus aurantifolia - لیمو عمانی، لیمو ترش

Refrences & Litretures:


672. Journal:'Molecules' Year:'2012' Volume:'17' Page:'11173' DOI:'10.3390/molecules170911173' Title:'Chemical Composition of Hexane Extract of Citrus aurantifolia and Anti-Mycobacterium tuberculosis Activity of Some of Its Constituents'

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