ChemSpider 2D Image | (1E,4E)-N-Benzyl-4-[{4-[benzyl(ethyl)amino]phenyl}(5-hydroxy-2,4-disulfophenyl)methylene]-N-ethyl-2,5-cyclohexadien-1-iminium | C37H37N2O7S2

(1E,4E)-N-Benzyl-4-[{4-[benzyl(ethyl)amino]phenyl}(5-hydroxy-2,4-disulfophenyl)methylene]-N-ethyl-2,5-cyclohexadien-1-iminium

  • Molecular FormulaC37H37N2O7S2
  • Average mass685.828 Da
  • Monoisotopic mass685.203674 Da
  • ChemSpider ID360455

  • Charge - Charge

More details:

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

(1E,4E)-N-Benzyl-4-[{4-[benzyl(ethyl)amino]phenyl}(5-hydroxy-2,4-disulfophenyl)methylen]-N-ethyl-2,5-cyclohexadien-1-iminium [German] [ACD/IUPAC Name]
(1E,4E)-N-Benzyl-4-[{4-[benzyl(ethyl)amino]phenyl}(5-hydroxy-2,4-disulfophenyl)methylene]-N-ethyl-2,5-cyclohexadien-1-iminium [ACD/IUPAC Name]
(1E,4E)-N-Benzyl-4-[{4-[benzyl(éthyl)amino]phényl}(5-hydroxy-2,4-disulfophényl)méthylène]-N-éthyl-2,5-cyclohexadién-1-iminium [French] [ACD/IUPAC Name]
Benzenemethanaminium, N-ethyl-N-[(1E,4E)-4-[[4-[ethyl(phenylmethyl)amino]phenyl](5-hydroxy-2,4-disulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]- [ACD/Index Name]
222-161-8 [EINECS]
32326-97-9 [RN]
3374-30-9 [RN]
Acid Leather Blue A
Acidal Carmine Blue A
Amacid Blue A
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C.I. 42052 [DBID]
C.I. 42052 (Ca salt) [DBID]
C.I. 42052 (Ca salt) (VAN) [DBID]
NSC 5017 [DBID]
NSC5017 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 152 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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