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Compound: 5546
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References: 992
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Carbazole
ScientificNameLabel
Carbazole
PHCD compound ID :
5510
Chemical Names :
Carbazole
Molecular Formula :
C12H9N1
Molecular Weight :
167.073499
More Details :
Names & Synonyms:
9H-carbazole , 9
H
-carbazole
Smiles:
c1ccc2c(c1)[nH]c1c2cccc1
InChi :
InChI=1S/C12H9N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8,13H
InChi Key :
InChIKey=UJOBWOGCFQCDNV-UHFFFAOYSA-N
PubChem ID :
6854
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
8.425806
Hydrogen bond donor count :
1
Electric dipole moment :
1.346
XLogP :
2.027
VDW volume :
141.516906
Molecular weight :
167.073499
HOMO-LUMO gap :
8.049000
Herb list :
Globe thistle - Echinops robustus - شکرتیغال غول آسا
Refrences & Litretures:
923. Journal:'Letters in Applied NanoBioScience' Year:'2020' Volume:'9' Page:'849' DOI:'10.33263/LIANBS91.849852' Title:'Chemical composition and antibacterial activity of methanolic extract from Echinops robustus on typical food-borne pathogens'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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