DISPERSE RED 13

• Catalog Number: ACM3180812
• Product Name: DISPERSE RED 13
• CAS: 3180-81-2
• Category: Disperse Dyes
• Synonyms: CI 11115;CELLITON RUBINE B;DISPERSE RED 13;ACETAMINE RUBINE B;2-[4-(2-CHLORO-4-NITROPHENYLAZO)-N-ETHYLPHENYLAMINO]ETHANOL;SETACYL RED 2B;2-((4-((2-chloro-4-nitrophenyl)azo)phenyl)ethylamino-ethano;2-[[4-[(2-chloro-4-nitrophenyl)azo]phenyl]ethylamino]-etha
• IUPAC Name: 2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethanol
• Molecular Weight: 348.78g/mol
• Molecular Formula: C16H17ClN4O3
• Canonical SMILES: CCN(CCO)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl
• InChI: InChI=1S/C16H17ClN4O3/c1-2-20(9-10-22)13-5-3-12(4-6-13)18-19-16-8-7-14(21(23)24)11-15(16)17/h3-8,11,22H,2,9-10H2,1H3
• InChI Key: FEJPWLNPOFOBSP-UHFFFAOYSA-N
• Melting Point: 133.0 °C
• Complexity: 424
• Covalently-Bonded Unit Count: 1
• EC Number: 221-668-1
• Exact Mass: 348.098918g/mol
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 1
• Heavy Atom Count: 24
• Monoisotopic Mass: 348.098918g/mol
• Rotatable Bond Count: 6
• UNII: 8GO3E3725A
• XLogP3: 4