ChemSpider 2D Image | (3Z)-5-({4-Chloro-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-3-[(4-methyl-2-sulfophenyl)hydrazono]-4-oxo-3,4-dihydro-2,7-naphthalenedisulfonic acid | C27H22ClN7O10S3

(3Z)-5-({4-Chloro-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-3-[(4-methyl-2-sulfophenyl)hydrazono]-4-oxo-3,4-dihydro-2,7-naphthalenedisulfonic acid

  • Molecular FormulaC27H22ClN7O10S3
  • Average mass736.153 Da
  • Monoisotopic mass735.027893 Da
  • ChemSpider ID4587284

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-5-({4-Chlor-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-3-[(4-methyl-2-sulfophenyl)hydrazono]-4-oxo-3,4-dihydro-2,7-naphthalindisulfonsäure [German] [ACD/IUPAC Name]
(3Z)-5-({4-Chloro-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-3-[(4-methyl-2-sulfophenyl)hydrazono]-4-oxo-3,4-dihydro-2,7-naphthalenedisulfonic acid [ACD/IUPAC Name]
2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl]amino]-3,4-dihydro-3-[2-(4-methyl-2-sulfophenyl)hydrazinylidene]-4-oxo-, (3Z)- [ACD/Index Name]
Acide (3Z)-5-({4-chloro-6-[méthyl(phényl)amino]-1,3,5-triazin-2-yl}amino)-3-[(4-méthyl-2-sulfophényl)hydrazono]-4-oxo-3,4-dihydro-2,7-naphtalènedisulfonique [French] [ACD/IUPAC Name]
(3Z)-5-({4-CHLORO-6-[METHYL(PHENYL)AMINO]-1,3,5-TRIAZIN-2-YL}AMINO)-3-[2-(4-METHYL-2-SULFOPHENYL)HYDRAZIN-1-YLIDENE]-4-OXONAPHTHALENE-2,7-DISULFONIC ACID
2,7-NAPHTHALENEDISULFONIC ACID 5-[[4-CHLORO-6-(METHYLPHENYLAMINO)-1,3,5-TRIAZIN-2-YL]AMINO]-4-HYDROXY-3-[(4-METHYL-2-SULFOPHENYL)AZO]-
2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-2-sulfophenyl)azo)-
73287-61-3 [RN]
ADS J2

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: 1.764
Molar Refractivity: 173.4±0.5 cm3
#H bond acceptors: 17
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 1.34
ACD/LogD (pH 5.5): -6.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 284 Å2
Polarizability: 68.7±0.5 10-24cm3
Surface Tension: 79.9±7.0 dyne/cm
Molar Volume: 420.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement