5-chloroorcylaldehyde

ScientificNameLabel

5-chloroorcylaldehyde
PHCD compound ID :	4566
Chemical Names :	5-chloroorcylaldehyde
Molecular Formula :	C8H7Cl1O3
Molecular Weight :	186.008372

More Details :

Names & Synonyms:
Smiles:	O=Cc1c(O)cc(c(c1C)Cl)O
InChi :	InChI=1S/C8H7ClO3/c1-4-5(3-10)6(11)2-7(12)8(4)9/h2-3,11-12H,1H3
InChi Key :	InChIKey=PNYFAHZOTZFWGP-UHFFFAOYSA-N
PubChem ID :

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	3	Ionization potential :	9.381903
Hydrogen bond donor count :	2	Electric dipole moment :	0.987
XLogP :	1.455	VDW volume :	154.70379
Molecular weight :	186.008372	HOMO-LUMO gap :	8.405000

Herb list :

Wild garlic - Allium hirtifolium - موسیر

Refrences & Litretures:


702. Journal:'J Microbiol Biotech Food Sci' Year:'2014' Volume:'3' Page:'402' DOI:'' Title:'CHEMICAL COMPOSITION, ANTIOXIDANT AND ANTIMICROBIAL ACTIVITY OF ALLIUM HIRTIFOLIUM ESSENTIAL OIL'

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