Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
N-ethylethanaminium 4-aminobenzoate 6018-84-4 22369
Structure Other Information
Canonical SMILES CC[NH2+]CC.C1=CC(=CC=C1C(=O)[O-])N
Iso SMILES CC[NH2+]CC.C1=CC(=CC=C1C(=O)[O-])N
InChI InChI=1S/C7H7NO2.C4H11N/c8-6-3-1-5(2-4-6)7(9)10;1-3-5-4-2/h1-4H,8H2,(H,9,10);5H,3-4H2,1-2H3
InChI Key XMYMCNNZVQZVJW-UHFFFAOYSA-N
Formula C11H18N2O2
Mol Weight 210.27
XlogP3 0
Charge 0

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Synonyms Information
CAS Name 4-aminobenzoate;diethylazanium
IUPAC Name 4-aminobenzoate;diethylazanium
Openeye Name 4-aminobenzoate;diethylazanium
Systematic Name 4-aminobenzoate;diethylazanium
Tratitional Name 4-aminobenzoate;diethylazanium