2,5-dimethyl-4-ethylthiazole

ScientificNameLabel

2,5-dimethyl-4-ethylthiazole
PHCD compound ID :	5302
Chemical Names :	2,5-dimethyl-4-ethylthiazole
Molecular Formula :	C7H11N1S1
Molecular Weight :	141.06122

More Details :

Names & Synonyms:	4-ethyl-2,5-dimethyl-thiazole , 4-ethyl-2,5-dimethylthiazole , 4-ethyl-2,5-dimethyl-1,3-thiazole
Smiles:	CCc1nc(sc1C)C
InChi :	InChI=1S/C7H11NS/c1-4-7-5(2)9-6(3)8-7/h4H2,1-3H3
InChi Key :	InChIKey=ZJGXJKFDKNNBTK-UHFFFAOYSA-N
PubChem ID :	36098

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	8.970425
Hydrogen bond donor count :	0	Electric dipole moment :	1.188
XLogP :	1.107	VDW volume :	130.604759
Molecular weight :	141.06122	HOMO-LUMO gap :	8.437000

Herb list :

- Ferula foetida - آنقوزه، گندکما

Refrences & Litretures:


855. Journal:'National Congress on Medicinal Plants' Year:'2015' Volume:'' Page:'645' DOI:'' Title:'Chemical composition of the essential oil from stems, leaves and flowers of Ferula foetida (Bunge) Regel. From Iran'

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