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ScientificNameLabel
Pyrrole
PHCD compound ID : 1153
Chemical Names :
Pyrrole , 1H-pyrrole
Molecular Formula : C4H5N1
Molecular Weight : 67.042199
More Details :
Names & Synonyms: pyrrole , 1H-pyrrole
Smiles: c1ccc[nH]1
InChi : InChI=1S/C4H5N/c1-2-4-5-3-1/h1-5H
InChi Key : InChIKey=KAESVJOAVNADME-UHFFFAOYSA-N
PubChem ID : 8027
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.019152
Hydrogen bond donor count : 1 Electric dipole moment : 2.256
XLogP : 0.819 VDW volume : 60.207781
Molecular weight : 67.042199 HOMO-LUMO gap : 10.023000
Herb list :
Refrences & Litretures:
  
119.      Journal:'World Appl. Sci. J'      Year:'2011'      Volume:'17'      Page:'67'      DOI:''      Title:'GC-MS Analysis of Various Extracts from Leaf of Plantago major Used as Traditional Medicine'
251.      Journal:'Journal of Essential Oil Research'      Year:'2004'      Volume:'16'      Page:'318'      DOI:'10.1080/10412905.2004.9698731'      Title:'Volatile Components of Tamarind (Tamarindus indica L.) Grown in Cuba'
339.      Journal:'J. Agric. Food Chem'      Year:'1978'      Volume:'26'      Page:'1290'      DOI:'10.1021/jf60220a012'      Title:'Volatile components of corn silk (Zea mays L.): possible Heliothis zea (Boddie) attractants'
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