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ScientificNameLabel
Tenamfetamine
PHCD compound ID : 4126
Chemical Names :
Tenamfetamine
Molecular Formula : C10H13N1O2
Molecular Weight : 179.094629
More Details :
Names & Synonyms: 1-(1,3-benzodioxol-5-yl)propan-2-amine , 1-(1,3-benzodioxol-5-yl)-2-propanamine , [2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]amine
Smiles: C[C@H](Cc1ccc2c(c1)OCO2)N
InChi : InChI=1S/C10H13NO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6,11H2,1H3/t7-/m1/s1
InChi Key : InChIKey=NGBBVGZWCFBOGO-SSDOTTSWSA-N
PubChem ID : 1614
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 8.765426
Hydrogen bond donor count : 1 Electric dipole moment : 1.650
XLogP : 0.918 VDW volume : 166.571225
Molecular weight : 179.094629 HOMO-LUMO gap : 8.730000
Herb list :
Refrences & Litretures:
  
575.      Journal:'J. Chin. Chem. Soc'      Year:'2013'      Volume:'60'      Page:'649'      DOI:'10.1002/jccs.201300133'      Title:'Improvement of GC-MS Analysis of Shahrbabak Ziziphora tenuior Essential Oil by Using Multivariate Curve Resolution Approaches'
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