Propanoic acid,2-chloro-

ScientificNameLabel

Propanoic acid,2-chloro-
PHCD compound ID :	3392
Chemical Names :	Propanoic acid,2-chloro-
Molecular Formula :	C3H5Cl1O2
Molecular Weight :	107.997807

More Details :

Names & Synonyms:	2-chloropropanoic acid , 2-chloranylpropanoic acid , 2-chloropropionic acid
Smiles:	C[C@H](C(=O)O)Cl
InChi :	InChI=1S/C3H5ClO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)/t2-/m1/s1
InChi Key :	InChIKey=GAWAYYRQGQZKCR-UWTATZPHSA-N
PubChem ID :	11734

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	11.085249
Hydrogen bond donor count :	1	Electric dipole moment :	2.321
XLogP :	0.45	VDW volume :	90.599475
Molecular weight :	107.997807	HOMO-LUMO gap :	10.826000

Herb list :

Garlic - Allium sativum - سیر

Refrences & Litretures:


469. Journal:'International Journal of Pharmaceutical Sciences and Drug Research' Year:'2013' Volume:'5' Page:'187' DOI:'' Title:'Antimicrobial Activity and the Chemical Composition of the Volatile Oil Blend from Allium sativum (Garlic Clove) and Citrus reticulate (Tangerine Fruit)'

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