Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Epinephrine 51-43-4 5816

Structure Other Information
Canonical SMILES CNCC(C1=CC(=C(C=C1)O)O)O
Iso SMILES CNC[C@@H](C1=CC(=C(C=C1)O)O)O
InChI InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1
InChI Key UCTWMZQNUQWSLP-VIFPVBQESA-N
Formula C9H13NO3
Mol Weight 183.204
XlogP3 -1.4
Charge 0

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Synonyms Information
CAS Name 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
IUPAC Name 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
Openeye Name 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
Systematic Name 4-[(1R)-2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol
Tratitional Name 4-[(1R)-2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol