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Compound: 5546
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References: 992
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2-(2'-Hydroxypropyl)delta1-piperideine
ScientificNameLabel
2-(2'-Hydroxypropyl)delta1-piperideine
PHCD compound ID :
4449
Chemical Names :
2-(2'-Hydroxypropyl)delta1-piperideine
Molecular Formula :
C8H15N1O1
Molecular Weight :
141.115364
More Details :
Names & Synonyms:
Smiles:
C[C@H](CC1=NCCCC1)O
InChi :
InChI=1S/C8H15NO/c1-7(10)6-8-4-2-3-5-9-8/h7,10H,2-6H2,1H3/t7-/m1/s1
InChi Key :
InChIKey=BSNNGTDGJAVMGJ-SSDOTTSWSA-N
PubChem ID :
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.662210
Hydrogen bond donor count :
1
Electric dipole moment :
2.448
XLogP :
0.31
VDW volume :
151.718405
Molecular weight :
141.115364
HOMO-LUMO gap :
10.833000
Herb list :
Pomegranate - Punica granatum - گلنار، انار
Refrences & Litretures:
658. Journal:'Journal of Ethnopharmacology' Year:'2007' Volume:'109' Page:'177' DOI:'10.1016/j.jep.2006.09.006' Title:'Punica granatum (pomegranate) and its potential for prevention and treatment of in?ammation and cancer'
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