Cyclopropanebutanoic acid

ScientificNameLabel

Cyclopropanebutanoic acid
PHCD compound ID :	2698
Chemical Names :	Cyclopropanebutanoic acid
Molecular Formula :	C7H12O2
Molecular Weight :	128.08373

More Details :

Names & Synonyms:	4-cyclopropylbutanoic acid , 4-cyclopropylbutyric acid
Smiles:	OC(=O)CCCC1CC1
InChi :	InChI=1S/C7H12O2/c8-7(9)3-1-2-6-4-5-6/h6H,1-5H2,(H,8,9)
InChi Key :	InChIKey=QTFPLPYKIHFSLC-UHFFFAOYSA-N
PubChem ID :	19758456

Rotatable bond count :	4	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	11.016202
Hydrogen bond donor count :	1	Electric dipole moment :	1.858
XLogP :	2.048	VDW volume :	132.215887
Molecular weight :	128.08373	HOMO-LUMO gap :	11.949000

Herb list :

Common purslane - Portulaca oleracea - خرفه

Refrences & Litretures:


312. Journal:'Talanta' Year:'2010' Volume:'81' Page:'129' DOI:'10.1016/j.talanta.2009.11.047' Title:'Identi?cation of Portulaca oleracea L. from different sources using GC–MS and FT-IR spectroscopy'

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