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1-Propanol,2-ethoxy-
ScientificNameLabel
1-Propanol,2-ethoxy-
PHCD compound ID :
4406
Chemical Names :
1-Propanol,2-ethoxy-
Molecular Formula :
C5H12O2
Molecular Weight :
104.08373
More Details :
Names & Synonyms:
2-ethoxypropan-1-ol , 2-ethoxy-1-propanol
Smiles:
CCO[C@H](CO)C
InChi :
InChI=1S/C5H12O2/c1-3-7-5(2)4-6/h5-6H,3-4H2,1-2H3/t5-/m0/s1
InChi Key :
InChIKey=DEDUBNVYPMOFDR-YFKPBYRVSA-N
PubChem ID :
29420
Rotatable bond count :
3
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
10.038685
Hydrogen bond donor count :
1
Electric dipole moment :
2.627
XLogP :
0.194
VDW volume :
112.616835
Molecular weight :
104.08373
HOMO-LUMO gap :
12.232000
Herb list :
Pomegranate - Punica granatum - گلنار، انار
Refrences & Litretures:
656. Journal:'Int. J. LifeSc. Bt & Pharm. Res' Year:'2012' Volume:'1' Page:'164' DOI:'' Title:'ANTIBACTERIAL ACTIVITY OF PUNICA GRANATUM PEEL EXTRACTS AGAINST SHIGA TOXIN PRODUCING E. COLI'
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