ChemSpider 2D Image | Reactive Yellow 3 | C21H17ClN8O7S2

Reactive Yellow 3

  • Molecular FormulaC21H17ClN8O7S2
  • Average mass592.992 Da
  • Monoisotopic mass592.035034 Da
  • ChemSpider ID71037

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,5-Naphthalenedisulfonic acid, 3-[(E)-2-[2-(acetylamino)-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]- [ACD/Index Name]
3-[(E)-{2-Acetamido-4-[(4-amino-6-chlor-1,3,5-triazin-2-yl)amino]phenyl}diazenyl]-1,5-naphthalindisulfonsäure [German] [ACD/IUPAC Name]
3-[(E)-{2-Acetamido-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl}diazenyl]-1,5-naphthalenedisulfonic acid [ACD/IUPAC Name]
3-[2-[2-(Acetylamino)-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]-1,5-naphthalenedisulfonic acid
6539-67-9 [RN]
Acide 3-[(E)-{2-acétamido-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phényl}diazényl]-1,5-naphtalènedisulfonique [French] [ACD/IUPAC Name]
Reactive Yellow 3
[6539-67-9] [RN]
1,5-Naphthalenedisulfonic acid, 3-((2-(acetylamino)-4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)phenyl)azo)-
1,5-Naphthalenedisulfonic acid, 3-[[2-(acetylamino)-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]azo]-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.795
Molar Refractivity: 138.9±0.5 cm3
#H bond acceptors: 15
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 0.70
ACD/LogD (pH 5.5): -4.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 256 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 85.2±7.0 dyne/cm
Molar Volume: 326.6±7.0 cm3

Click to predict properties on the Chemicalize site


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