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3-Ethyl-2,2-dimethyloxazoldine
ScientificNameLabel
3-Ethyl-2,2-dimethyloxazoldine
PHCD compound ID :
3124
Chemical Names :
3-Ethyl-2,2-dimethyloxazoldine
Molecular Formula :
C7H15N1O1
Molecular Weight :
129.115364
More Details :
Names & Synonyms:
Smiles:
CCN1CCOC1(C)C
InChi :
InChI=1S/C7H15NO/c1-4-8-5-6-9-7(8,2)3/h4-6H2,1-3H3
InChi Key :
InChIKey=XILOMQLTERMTIR-UHFFFAOYSA-N
PubChem ID :
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.022274
Hydrogen bond donor count :
0
Electric dipole moment :
1.283
XLogP :
1.1
VDW volume :
137.058879
Molecular weight :
129.115364
HOMO-LUMO gap :
11.448000
Herb list :
Rue - Ruta graveolens - سداب
Refrences & Litretures:
426. Journal:'Jordan Journal of Biological Sciences' Year:'2015' Volume:'8' Page:'139' DOI:'' Title:'The Chemical Composition and the Antibacterial Properties of Ruta graveolens L. Essential Oil Grown in Northern Jordan'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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