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1,1-dimethylpyrrolidinium-2-carboxylate
PHCD compound ID : 4162
Chemical Names :
1,1-dimethylpyrrolidinium-2-carboxylate
Molecular Formula : C7H13N1O2
Molecular Weight : 143.094629
More Details :
Names & Synonyms: 1,1-dimethylpyrrolidin-1-ium-2-carboxylate , 1,1-dimethyl-2-pyrrolidin-1-iumcarboxylate
Smiles: [O-]C(=O)[C@@H]1CCC[N+]1(C)C
InChi : InChI=1S/C7H13NO2/c1-8(2)5-3-4-6(8)7(9)10/h6H,3-5H2,1-2H3/t6-/m0/s1
InChi Key : InChIKey=CMUNUTVVOOHQPW-LURJTMIESA-N
PubChem ID : 554
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 8.818963
Hydrogen bond donor count : 0 Electric dipole moment : 11.507
XLogP : -0.618 VDW volume : 143.212647
Molecular weight : 143.094629 HOMO-LUMO gap : 9.105000
Herb list :
Refrences & Litretures:
  
579.      Journal:'Int J Diabetol Vasc Dis Res'      Year:'2015'      Volume:'3'      Page:'99'      DOI:'10.19070/2328-353X-1500020'      Title:'Pharmacological Properties of Capparis spinosa Linn'
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