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Compound: 5546
Plants: 312
References: 992
Visitors: 50
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Thiophene
ScientificNameLabel
Thiophene
PHCD compound ID :
1151
Chemical Names :
Thiophene
Molecular Formula :
C4H4S1
Molecular Weight :
84.003371
More Details :
Names & Synonyms:
thiophene
Smiles:
c1cccs1
InChi :
InChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H
InChi Key :
InChIKey=YTPLMLYBLZKORZ-UHFFFAOYSA-N
PubChem ID :
8030
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.043947
Hydrogen bond donor count :
0
Electric dipole moment :
0.362
XLogP :
1.459
VDW volume :
67.720045
Molecular weight :
84.003371
HOMO-LUMO gap :
8.685000
Herb list :
Globe thistle - Echinops robustus - شکرتیغال غول آسا
Great plantain, Waybread - Plantago major - بارهنگ كبير، بارهنگ
Rocket, Roquette - Eruca sativa - منداب
Refrences & Litretures:
119. Journal:'World Appl. Sci. J' Year:'2011' Volume:'17' Page:'67' DOI:'' Title:'GC-MS Analysis of Various Extracts from Leaf of Plantago major Used as Traditional Medicine'
844. Journal:'Flavour Fragr. J' Year:'2002' Volume:'17' Page:'187' DOI:'10.1002/ffj.1079' Title:'Composition of the essential oil from the leaves of Eruca sativa'
923. Journal:'Letters in Applied NanoBioScience' Year:'2020' Volume:'9' Page:'849' DOI:'10.33263/LIANBS91.849852' Title:'Chemical composition and antibacterial activity of methanolic extract from Echinops robustus on typical food-borne pathogens'
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