Propiolic Acid

ScientificNameLabel

Propiolic Acid
PHCD compound ID :	1166
Chemical Names :	Propiolic Acid
Molecular Formula :	C3H2O2
Molecular Weight :	70.005479

More Details :

Names & Synonyms:	prop-2-ynoic acid , 2-propynoic acid , propiolic acid
Smiles:	OC(=O)C#C
InChi :	InChI=1S/C3H2O2/c1-2-3(4)5/h1H,(H,4,5)
InChi Key :	InChIKey=UORVCLMRJXCDCP-UHFFFAOYSA-N
PubChem ID :	10110

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	11.554045
Hydrogen bond donor count :	1	Electric dipole moment :	1.992
XLogP :	0.195	VDW volume :	70.11549
Molecular weight :	70.005479	HOMO-LUMO gap :	11.165000

Herb list :

Great plantain, Waybread - Plantago major - بارهنگ كبير، بارهنگ

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'

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