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ScientificNameLabel
Dichlorobenzene
PHCD compound ID : 5482
Chemical Names :
Dichlorobenzene
Molecular Formula : C6H4Cl2
Molecular Weight : 145.969005
More Details :
Names & Synonyms: 1,4-dichlorobenzene , 1,4-bis(chloranyl)benzene
Smiles: Clc1ccc(cc1)Cl
InChi : InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
InChi Key : InChIKey=OCJBOOLMMGQPQU-UHFFFAOYSA-N
PubChem ID : 4685
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.840015
Hydrogen bond donor count : 0 Electric dipole moment : 0.002
XLogP : 1.97 VDW volume : 111.588667
Molecular weight : 145.969005 HOMO-LUMO gap : 9.161000
Herb list :
Refrences & Litretures:
  
917.      Journal:'International Letters of Chemistry, Physics and Astronomy'      Year:'2013'      Volume:'13'      Page:'210'      DOI:'10.18052/www.scipress.com/ILCPA.13.210'      Title:'Chemical composition of Marrubium vulgare L. essential oil from Algeria'
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