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ScientificNameLabel
3-Quinolinecarboxylic acid
PHCD compound ID : 2665
Chemical Names :
3-Quinolinecarboxylic acid
Molecular Formula : C10H7N1O2
Molecular Weight : 173.047678
More Details :
Names & Synonyms: quinoline-3-carboxylic acid , 3-quinolinecarboxylic acid
Smiles: OC(=O)c1cnc2c(c1)cccc2
InChi : InChI=1S/C10H7NO2/c12-10(13)8-5-7-3-1-2-4-9(7)11-6-8/h1-6H,(H,12,13)
InChi Key : InChIKey=DJXNJVFEFSWHLY-UHFFFAOYSA-N
PubChem ID : 80971
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.772883
Hydrogen bond donor count : 1 Electric dipole moment : 1.829
XLogP : 0.407 VDW volume : 147.761849
Molecular weight : 173.047678 HOMO-LUMO gap : 8.371000
Herb list :
Refrences & Litretures:
  
309.      Journal:'BioMed Research International'      Year:'2015'      Volume:''      Page:'925631'      DOI:'10.1155/2015/925631'      Title:'Portulaca oleracea L.: A Review of Phytochemistry and Pharmacological Effects'
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