Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Disperse blue 106 12223-01-7, 68516-81-4 108061
Structure Other Information
Canonical SMILES CCN(CCO)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])C
Iso SMILES CCN(CCO)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])C
InChI InChI=1S/C14H17N5O3S/c1-3-18(6-7-20)11-4-5-12(10(2)8-11)16-17-14-15-9-13(23-14)19(21)22/h4-5,8-9,20H,3,6-7H2,1-2H3
InChI Key UIHYHADQHHUIOF-UHFFFAOYSA-N
Formula C14H17N5O3S
Mol Weight 335.381
XlogP3 3.4
Charge 0

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Synonyms Information
CAS Name 2-[N-ethyl-3-methyl-4-[(5-nitro-2-thiazolyl)azo]anilino]ethanol
IUPAC Name 2-[N-ethyl-3-methyl-4-(5-nitrothiazol-2-yl)azo-anilino]ethanol
Openeye Name 2-[N-ethyl-3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]anilino]ethanol
Systematic Name 2-[ethyl-[3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl]amino]ethanol
Tratitional Name 2-[ethyl-[3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl]amino]ethanol