Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Disperse Red 1 / C.I. 11110 2872-52-8 17886
Structure Other Information
Canonical SMILES CCN(CCO)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]
Iso SMILES CCN(CCO)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]
InChI InChI=1S/C16H18N4O3/c1-2-19(11-12-21)15-7-3-13(4-8-15)17-18-14-5-9-16(10-6-14)20(22)23/h3-10,21H,2,11-12H2,1H3
InChI Key FOQABOMYTOFLPZ-UHFFFAOYSA-N
Formula C16H18N4O3
Mol Weight 314.339
XlogP3 3.3
Charge 0

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Synonyms Information
CAS Name 2-[N-ethyl-4-(4-nitrophenyl)azoanilino]ethanol
IUPAC Name 2-[N-ethyl-4-(4-nitrophenyl)azo-anilino]ethanol
Openeye Name 2-[N-ethyl-4-[(4-nitrophenyl)diazenyl]anilino]ethanol
Systematic Name 2-[ethyl-[4-[(4-nitrophenyl)diazenyl]phenyl]amino]ethanol
Tratitional Name 2-[ethyl-[4-[(4-nitrophenyl)diazenyl]phenyl]amino]ethanol