2-Chlorobenzoic acid

ScientificNameLabel

2-Chlorobenzoic acid
PHCD compound ID :	1392
Chemical Names :	2-Chlorobenzoic acid
Molecular Formula :	C7H5Cl1O2
Molecular Weight :	155.997807

More Details :

Names & Synonyms:	2-chlorobenzoic acid , 2-chloranylbenzoic acid
Smiles:	OC(=O)c1ccccc1Cl
InChi :	InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)
InChi Key :	InChIKey=IKCLCGXPQILATA-UHFFFAOYSA-N
PubChem ID :	8374

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	10.072914
Hydrogen bond donor count :	1	Electric dipole moment :	3.480
XLogP :	1.137	VDW volume :	128.617579
Molecular weight :	155.997807	HOMO-LUMO gap :	9.117000

Herb list :

Rice - Oryza sativa - برنج

Refrences & Litretures:


148. Journal:'Crop Protection' Year:'2002' Volume:'21' Page:'913' DOI:'' Title:'Screening of allelochemicals on barnyardgrass (Echinochloa crus-galli) and identi?cation of potentially allelopathic compounds from rice (Oryza sativa) variety hull extracts'

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