5-Methyl-1,3-thiazole

ScientificNameLabel

5-Methyl-1,3-thiazole
PHCD compound ID :	5056
Chemical Names :	5-Methyl-1,3-thiazole
Molecular Formula :	C4H5N1S1
Molecular Weight :	99.01427

More Details :

Names & Synonyms:	5-methylthiazole , 5-methyl-1,3-thiazole
Smiles:	Cc1cncs1
InChi :	InChI=1S/C4H5NS/c1-4-2-5-3-6-4/h2-3H,1H3
InChi Key :	InChIKey=RLYUNPNLXMSXAX-UHFFFAOYSA-N
PubChem ID :	137980

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	9.555276
Hydrogen bond donor count :	0	Electric dipole moment :	2.516
XLogP :	0.453	VDW volume :	78.716805
Molecular weight :	99.01427	HOMO-LUMO gap :	8.715000

Herb list :

Onoin - Allium cepa - پیاز

Refrences & Litretures:


786. Journal:'Journal of Food Quality' Year:'2017' Volume:'' Page:'6873651' DOI:'10.1155/2017/6873651' Title:'Chemical Composition and Antioxidant Properties of Five White Onion (Allium cepa L.) Landraces'

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